SCHEMBL453375

SCHEMBL453375

CC1=C(C=O)CCc2cc(O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MIF P14174 11/20 0.47
MAOB P27338 2/20 0.45
MAOA P21397 1/20 0.45
PRKCI P41743 1/20 0.45
CYP26A1 O43174 3/20 0.44
HSP90AA1 P07900 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
CYP19A1 P11511 1/20 0.40
AKR1B1 P15121 1/20 0.40
PBRM1 Q86U86 1/20 0.40
HSD17B1 P14061 1/20 0.39

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
SCHEMBL449192 0.81 MAOB (0.46) MIFMAOBMAOAPRKCICYP26A1
SCHEMBL29582422 0.81 MAOB (0.46) MIFMAOBMAOAPRKCICYP26A1
SCHEMBL316466 0.78 CYP26A1 (0.48) MIFCYP26A1CYP19A1
SCHEMBL10088634 0.75 MAOB (0.56) MIFMAOBMAOAESR1ESR2
SCHEMBL12522126 0.73 TYMS (0.43) CYP19A1
SCHEMBL784291 0.73 MAOB (0.59) MIFMAOBMAOAPRKCICYP26A1
SCHEMBL450942 0.72 MAOB (0.56) MAOBMAOA
SCHEMBL2327566 0.71 MIF (0.47) MIFMAOBMAOAESR1ESR2
SCHEMBL803069 0.71 MIF (0.54) MIFMAOBMAOAPRKCICYP26A1
SCHEMBL947551 0.70 S1PR1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025090792-A1 AMIDE PRODRUGS AND USES THEREOF AUTOBAHN THERAPEUTICS, INC. (US) 2025-05-01 WO disclosed
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2024-10-03 US disclosed
EP-4431157-A2 1-[[(3S)-3-METHYL-6-(4(4,4-TRIFLUOROBUTOXY)-3,4-DIHYDRONAPHTHALEN-2YL]METHYL]AZETIDINE-3-CARBOXYLIC ACID HAVING S1P5 RECEPTOR AGONIST ACTIVITY FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS AND CANCER ONO Pharmaceutical Co., Ltd. (JP) 2024-09-18 EP disclosed
US-12049445-B2 Compounds having S1P5 receptor agonistic activity ONO PHARMACEUTICAL CO., LTD. (JP) 2024-07-30 US disclosed
CN-111757869-B Compounds having S1P5 receptor agonistic activity 小野药品工业株式会社 2024-03-08 CN disclosed
US-11471436-B2 Dihydronaphthalene derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2022-10-18 US disclosed
US-20220055986-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2022-02-24 US disclosed
US-11198672-B2 Compounds having S1P5 receptor agonistic activity ONO PHARMACEUTICAL CO., LTD. (JP) 2021-12-14 US disclosed
US-20210087141-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2021-03-25 US disclosed
EP-3228615-B1 DIHYDRONAPHTHALENE DERIVATIVES USEFUL IN THE TREATMENT OF S1P5-MEDIATED DISEASES ONO PHARMACEUTICAL CO (JP) 2021-01-20 EP disclosed
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD (JP) 2011-01-27 US disclosed
US-7825109-B2 Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-02 US disclosed
US-20090275554-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2009-11-05 US disclosed
CN-101407471-A Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO (JP) 2009-04-15 CN disclosed
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US disclosed
EP-1826197-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-08-29 EP disclosed
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD (JP) 2007-07-19 US disclosed
EP-1760071-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-03-07 EP disclosed
CN-1874991-A Compounds capable of binding to the S1P receptor and pharmaceutical uses thereof ONO PHARMACEUTICAL CO (JP) 2006-12-06 CN disclosed
EP-1661881-A2 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 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 (10 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-12049445-B2 Compounds having S1P5 receptor agonistic activity S1PR5, S1PR1, S1PR4 MIF 4440/4885MAOB 2121/4885MAOA 2474/4885
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MIF 4440/4885MAOB 2121/4885MAOA 2474/4885
US-11198672-B2 Compounds having S1P5 receptor agonistic activity S1PR5, S1PR1, S1PR4 MIF 4440/4885MAOB 2121/4885MAOA 2474/4885
US-20210087141-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MIF 4440/4885MAOB 2121/4885MAOA 2474/4885
US-11471436-B2 Dihydronaphthalene derivative S1PR5, LPAR5, S1PR1 MIF 4258/4885MAOB 1406/4885MAOA 1661/4885
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof S1PR1, S1PR3, S1PR2 MIF 1346/4885MAOB 2689/4885MAOA 3402/4885
US-20220055986-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MIF 4440/4885MAOB 2121/4885MAOA 2474/4885
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof S1PR1, EDNRA, S1PR3 MIF 1315/4885MAOB 2137/4885MAOA 2174/4885
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF S1PR1, S1PR3, S1PR2 MIF 1346/4885MAOB 2689/4885MAOA 3402/4885
US-20090275554-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF EDNRA, EDNRB, S1PR1 MIF 1301/4885MAOB 1836/4885MAOA 1581/4885

“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.