SCHEMBL7775604

SCHEMBL7775604

Cc1ccc(C)c(-c2ccccc2N)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
TDP1 Q9NUW8 3/20 0.52
MAOB P27338 1/20 0.49
PLA2G7 Q13093 1/20 0.47
GAA P10253 7/20 0.46
KDM4E B2RXH2 6/20 0.46
MAPT P10636 4/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
RAB9A P51151 3/20 0.46
ELANE P08246 1/20 0.45
CYP3A4 P08684 2/20 0.43
ALOX15 P16050 2/20 0.43
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
HSD17B10 Q99714 6/20 0.42
GLA P06280 1/20 0.41
LMNA P02545 2/20 0.39
S1PR4 O95977 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
SCHEMBL3781663 0.87 ALDH1A1 (0.59) ALDH1A1L3MBTL1TDP1MAOBGAA
SCHEMBL17850800 0.85 ALDH1A1 (0.58) ALDH1A1L3MBTL1TDP1PLA2G7GAA
SCHEMBL3780745 0.83 PLA2G7 (0.67) ALDH1A1L3MBTL1TDP1PLA2G7GAA
SCHEMBL18550677 0.83 ALDH1A1 (0.54) ALDH1A1L3MBTL1TDP1MAOBGAA
SCHEMBL3786757 0.83 ALDH1A1 (0.59) ALDH1A1L3MBTL1TDP1MAOBGAA
SCHEMBL277747 0.82 ELANE (0.52) ALDH1A1L3MBTL1TDP1PLA2G7MAPT
SCHEMBL13856345 0.81 ALDH1A1 (0.45) ALDH1A1TDP1MAOBPLA2G7GAA
SCHEMBL31206446 0.80 ALDH1A1 (0.50) ALDH1A1L3MBTL1TDP1MAOBGAA
SCHEMBL398724 0.80 ALDH1A1 (0.68) ALDH1A1L3MBTL1TDP1MAOBPLA2G7
SCHEMBL10711689 0.79 ALDH1A1 (0.52) ALDH1A1L3MBTL1TDP1MAOBPLA2G7

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0840766-B1 STABILISED DYE COMPOSITION AVECIA LTD (GB) 2001-08-29 EP claimed
US-5869627-A WATER SOLUBLE BIS-AZO DYE ZENECA LIMITED (GB) 1999-02-09 US claimed
EP-3508491-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2020-09-09 EP disclosed
EP-3508491-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2019-07-10 EP disclosed
WO-2014009317-A1 BENZIMIDAZO[1,2-A]BENZIMIDAZOLE DERIVATIVES FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2014-01-16 WO disclosed
EP-0840766-B1 STABILISED DYE COMPOSITION AVECIA LTD (GB) 2001-08-29 EP disclosed
US-5869627-A WATER SOLUBLE BIS-AZO DYE ZENECA LIMITED (GB) 1999-02-09 US disclosed
EP-0840766-A1 STABILISED DYE COMPOSITION ZENECA LIMITED (GB) 1998-05-13 EP disclosed
WO-1997003132-A1 STABILISED DYE COMPOSITION ZENECA LIMITED (GB) 1997-01-30 WO disclosed
US-5453495-A Disazo compounds containing an optionally substituted piperazinyl group ZENECA LIMITED (GB) 1995-09-26 US disclosed
WO-1995017471-A1 DISAZO COMPOUND ZENECA LIMITED (GB) 1995-06-29 WO disclosed
WO-1995017472-A1 DISAZO COMPOUND ZENECA LIMITED (GB) 1995-06-29 WO disclosed
US-4670566-A ANTIIFLAMMATORY AGENTS, ANTICOAGULANTS A. H. ROBINS COMPANY, INCORPORATED (US) 1987-06-02 US disclosed
US-4440785-A Methods of using 2-aminobiphenylacetic acids, esters, and metal salts thereof to treat inflammation A. H. ROBINS COMPANY, INC. (US) 1984-04-03 US disclosed