SCHEMBL2816778

SCHEMBL2816778

CC(C)(CSc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.50
MTNR1A P48039 4/20 0.44
MTNR1B P49286 4/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
CYP2C19 P33261 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.39
PPARA Q07869 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL2026670 0.86 FFAR1 (0.48) FFAR1MTNR1AMTNR1BALDH1A1MAPK1
SCHEMBL7303734 0.86 PPARA (0.51) ALDH1A1NPC1RAB9APPARAL3MBTL1
SCHEMBL7350612 0.85 BLM (0.43) FFAR1ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL8101750 0.83 SMN1; SMN2 (0.49) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL6915551 0.82 FFAR1 (0.48) FFAR1MTNR1AMTNR1BALDH1A1MAPK1
SCHEMBL8026606 0.78 HSD17B10 (0.47) ALDH1A1MAPK1NPC1RAB9AMEN1
SCHEMBL9141295 0.77 FFAR1 (0.52) FFAR1MTNR1AMTNR1BALDH1A1MAPK1
SCHEMBL98007 0.77 ALDH1A1 (0.48) FFAR1MTNR1AMTNR1BALDH1A1MAPK1
SCHEMBL98008 0.77 ALDH1A1 (0.48) FFAR1MTNR1AMTNR1BALDH1A1MAPK1
SCHEMBL1527726 0.77 ALDH1A1 (0.48) FFAR1MTNR1AMTNR1BALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115698292-A Aptamers binding to thiamine analogs and derivatives 梅里特斯英国第二有限公司 2023-02-03 CN disclosed
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases MATIER WILLIAM L (US) 2013-05-23 US disclosed
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases MATIER WILLIAM L (US) 2013-05-23 US disclosed
US-8436035-B2 Organic compounds NOVARTIS AG (CH) 2013-05-07 US disclosed
US-8436035-B2 Organic compounds NOVARTIS AG (CH) 2013-05-07 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-7825134-B2 Amelioration of cataracts, macular degeneration and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2010-11-02 US disclosed
US-7825134-B2 Amelioration of cataracts, macular degeneration and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2010-11-02 US disclosed
EP-2094680-A2 IMIDAZOLES AS ALDOSTERONE SYNTHASE INHIBITORS Novartis AG (CH) 2009-09-02 EP disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
WO-2008076336-A2 IMIDAZOLES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2008-06-26 WO disclosed
WO-2008076336-A2 IMIDAZOLES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2008-06-26 WO disclosed
US-20050131025-A1 Amelioration of cataracts, macular degeneration and other ophthalmic diseases COLBY PHARMACEUTICAL COMPANY 2005-06-16 US 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 (3 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-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases C3AR1, C1R, AKR1C3 FFAR1 142/4885MTNR1A 471/4885MTNR1B 519/4885
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases C3AR1, C1R, AKR1C3 FFAR1 142/4885MTNR1A 471/4885MTNR1B 519/4885
US-20050131025-A1 Amelioration of cataracts, macular degeneration and other ophthalmic diseases C1R, CRYAB, C9 FFAR1 390/4885MTNR1A 319/4885MTNR1B 310/4885

“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.