SCHEMBL6573277

SCHEMBL6573277

Nc1ccc(N)c(-c2ccccc2O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.45
ALDH1A1 P00352 4/20 0.45
TDP1 Q9NUW8 4/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
TSHR P16473 2/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
ALOX15 P16050 2/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
POLB P06746 3/20 0.44
HPGD P15428 3/20 0.44
PTPRC P08575 2/20 0.44
BLM P54132 2/20 0.44
LMNA P02545 2/20 0.44
APAF1 O14727 1/20 0.44

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
SCHEMBL6573481 0.87 PDE10A (0.52) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL6572324 0.85 PDE10A (0.54) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL5687750 0.85 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL5688007 0.85 TSHR (0.48) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL3786791 0.83 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL6011189 0.83 NR1I2 (0.47) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL5133404 0.82 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL3791666 0.81 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL19486098 0.80 BRD4 (0.46) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A
SCHEMBL2068581 0.80 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1TDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110126396-B Laminated composite damping sheet and preparation method thereof 浙江工业大学 2022-01-14 CN claimed
CN-112358667-A Rubber composition and preparation method and application thereof 中国第一汽车股份有限公司 2021-02-12 CN claimed
EP-1051143-B1 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AG (DE) 2004-07-21 EP claimed
CN-112358667-B Rubber composition and preparation method and application thereof 中国第一汽车股份有限公司 2022-05-17 CN disclosed
CN-110126396-B Laminated composite damping sheet and preparation method thereof 浙江工业大学 2022-01-14 CN disclosed
CN-112358667-A Rubber composition and preparation method and application thereof 中国第一汽车股份有限公司 2021-02-12 CN disclosed
EP-1051143-B1 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AG (DE) 2004-07-21 EP disclosed
US-6500213-B1 Oxidizing hair coloring agents containing 2,5-diamino-1-phenylbenzene derivatives and novel 2,5-diamino-1-phenylbenzene derivatives WELLA AKTIENGESELLSCHAFT (DE) 2002-12-31 US disclosed
EP-1051143-A2 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES Wella Aktiengesellschaft (DE) 2000-11-15 EP disclosed
WO-1999059527-A2 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 WO disclosed