SCHEMBL448275

SCHEMBL448275

COc1ccc2c(c1)CCC(C=O)=C2Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 4/20 0.47
CYP19A1 P11511 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP26A1 O43174 3/20 0.45
LMNA P02545 1/20 0.45
CYP11B2 P19099 2/20 0.45
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 2/20 0.44
GLA P06280 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
MPO P05164 1/20 0.43
CYP27A1 Q02318 1/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
RAB9A P51151 1/20 0.43
NFKB2 Q00653 1/20 0.43

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
SCHEMBL29582798 1.00 MIF (0.47) MIFCYP19A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL29953520 0.88 MAOA (0.47) CYP19A1ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL6832547 0.88 MAOA (0.47) CYP19A1ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL316466 0.83 CYP26A1 (0.48) MIFCYP19A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL25314366 0.83 MAPT (0.41) MIFALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL30707980 0.83 MAPT (0.41) MIFALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL10470879 0.79 MIF (0.48) MIFCYP19A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL15333322 0.78 PDE4D (0.43) CYP19A1ALDH1A1MAPTCYP11B2KDM4E
SCHEMBL29582422 0.78 MAOB (0.46) MIFCYP19A1CYP26A1
SCHEMBL449192 0.78 MAOB (0.46) MIFCYP19A1CYP26A1

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 45 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-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-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
CN-117203189-A Process for preparing intermediates useful in the synthesis of sphingosine-1-phosphate receptor agonists 株式会社LG化学 2023-12-08 CN disclosed
CN-117136183-A Novel process for preparing sphingosine-1-phosphate receptor agonists 株式会社LG化学 2023-11-28 CN disclosed
CN-117136181-A Preparation method of intermediate for synthesizing sphingosine-1-phosphate receptor agonist 株式会社LG化学 2023-11-28 CN disclosed
EP-4219443-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST Lg Chem, Ltd. (KR) 2023-08-02 EP 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
EP-2342189-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR FOR THE TREATMENT OF OSTEOARTHRITIS ELI LILLY AND COMPANY (US) 2011-07-13 EP disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
WO-2010036497-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR ELI LILLY AND COMPANY (US) 2010-04-01 WO disclosed
WO-2010036497-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR ELI LILLY AND COMPANY (US) 2010-04-01 WO 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 (5 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-20120064060-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF S1PR1, S1PR3, EDNRA MIF 1221/4885CYP19A1 1167/4885ALDH1A1 2245/4885
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof S1PR1, EDNRA, S1PR3 MIF 1315/4885CYP19A1 1113/4885ALDH1A1 2082/4885
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ESRRA, GPER1, ESR2 MIF 1362/4885CYP19A1 9/4885ALDH1A1 405/4885
US-20240002322-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR5, S1PR1, S1PR3 MIF 4673/4885CYP19A1 1411/4885ALDH1A1 1426/4885
US-20240217935-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST S1PR4, S1PR1, S1PR3 MIF 4576/4885CYP19A1 1515/4885ALDH1A1 2640/4885

“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.