SCHEMBL449192

SCHEMBL449192

O=CC1=C(Cl)c2ccc(O)cc2CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
PRKCI P41743 1/20 0.46
MIF P14174 10/20 0.45
CYP26A1 O43174 3/20 0.45
AKR1B1 P15121 1/20 0.44
HSP90AA1 P07900 1/20 0.41
CYP19A1 P11511 1/20 0.41
PBRM1 Q86U86 1/20 0.41
HSD17B1 P14061 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29582422 1.00 MAOB (0.46) MAOBMAOAPRKCIMIFCYP26A1
SCHEMBL15173274 0.81 SRD5A1 (0.45) CYP19A1
SCHEMBL453375 0.81 MIF (0.47) MAOBMAOAPRKCIMIFCYP26A1
SCHEMBL448275 0.78 MIF (0.47) MIFCYP26A1CYP19A1
SCHEMBL31122387 0.78 CYP26A1 (0.41) MAOBMAOAMIFCYP26A1
SCHEMBL29582798 0.78 MIF (0.47) MIFCYP26A1CYP19A1
SCHEMBL29952458 0.77 ESR1 (0.54) MAOBMAOACYP19A1
SCHEMBL2063760 0.77 ESR1 (0.54) MAOBMAOACYP19A1
SCHEMBL10088633 0.76 MAOB (0.56) MAOBMAOAPRKCIMIFCYP19A1
SCHEMBL25314366 0.76 MAPT (0.41) MIF

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522554-B2 Method for preparing intermediate for synthesis of sphingosine-1-phosphate receptor agonist LG CHEM, LTD. (KR) 2026-01-13 US disclosed
US-20240228461-A1 NOVEL METHOD FOR PREPARING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST LG CHEM, LTD. (KR) 2024-07-11 US disclosed
US-20240228441-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST LG CHEM, LTD. (KR) 2024-07-11 US disclosed
US-20240217935-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST LG CHEM, LTD. (KR) 2024-07-04 US disclosed
US-20240217935-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST LG CHEM, LTD. (KR) 2024-07-04 US disclosed
EP-4306514-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
EP-4306516-A1 NOVEL METHOD FOR PREPARING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
EP-4306513-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
US-20240002322-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST LG CHEM, LTD. (KR) 2024-01-04 US disclosed
CN-117242057-A Process for preparing intermediates useful in the synthesis of sphingosine-1-phosphate receptor agonists 株式会社LG化学 2023-12-15 CN disclosed
US-9540362-B2 Sphingosine-1-phosphate receptor agonists, methods of preparing the same, and pharmaceutical compositions containing the same as an active agent LG LIFE SCIENCES LTD. (KR) 2017-01-10 US disclosed
US-20150376173-A1 SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONISTS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2015-12-31 US disclosed
EP-2958913-A1 SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONISTS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG Life Sciences Ltd. (KR) 2015-12-30 EP disclosed
CN-105051037-A Sphingosine-1-phosphate receptor agonists, method for the preparation thereof and pharmaceutical compositions comprising the same as active agent LG LIFE SCIENCES LTD 2015-11-11 CN disclosed
WO-2014129796-A1 SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONISTS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2014-08-28 WO disclosed
US-8653305-B2 Compound having S1P receptor binding potency and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2014-02-18 US disclosed
US-20120064060-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2012-03-15 US disclosed
US-8039674-B2 Amino-substituted cyclic compound for EDG-1(endothelial differentiation gene) and/or EDG-6-mediated diseases; transplant rejection, autoimmune diseases, allergies, asthma, multiple organ failure, ischemia, reperfusion injury, lung or liver fibrosis; antitumor agents ONO PHARMACEUTICAL CO., LTD. (JP) 2011-10-18 US disclosed
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US disclosed
EP-1760071-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-03-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150376173-A1 SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONISTS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT S1PR1, S1PR2, S1PR5 MAOB 2718/4885MAOA 2406/4885PRKCI 3034/4885
US-20120064060-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF S1PR1, S1PR3, EDNRA MAOB 2098/4885MAOA 2130/4885PRKCI 3388/4885
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof S1PR1, EDNRA, S1PR3 MAOB 2137/4885MAOA 2174/4885PRKCI 3315/4885
US-20240002322-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR5, S1PR1, S1PR3 MAOB 1983/4885MAOA 2357/4885PRKCI 2452/4885
US-20240228461-A1 NOVEL METHOD FOR PREPARING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR1, S1PR2, S1PR5 MAOB 2712/4885MAOA 3199/4885PRKCI 2136/4885
US-20240217935-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR4, S1PR1, S1PR3 MAOB 1796/4885MAOA 1887/4885PRKCI 3464/4885
US-20240228441-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR4, S1PR1, S1PR2 MAOB 1698/4885MAOA 1834/4885PRKCI 2764/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.