SCHEMBL4017171

SCHEMBL4017171

COc1ccc(-c2ccc3cc4ccccc4cc3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.59
CYP2A6 P11509 1/20 0.59
CYP11B2 P19099 5/20 0.57
CYP11B1 P15538 4/20 0.57
HSD17B1 P14061 1/20 0.57
HSD17B2 P37059 1/20 0.57
ABL1 P00519 2/20 0.55
ABCB1 P08183 2/20 0.55
BCR P11274 2/20 0.55
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
KDM4E B2RXH2 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
CYP17A1 P05093 3/20 0.51
CASP3 P42574 2/20 0.51
SENP8 Q96LD8 2/20 0.51

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
SCHEMBL29847374 1.00 CYP1A2 (0.59) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL29847312 1.00 CYP1A2 (0.59) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL1896522 0.94 CYP1A2 (0.68) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL28104773 0.94 HSD17B1 (0.63) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL28326739 0.89 CYP11B2 (0.49) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL20664519 0.89 HSD17B1 (0.70) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL28147639 0.89 HSD17B1 (0.68) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL11978648 0.88 CYP1A2 (0.79) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL29588373 0.88 CYP1A2 (0.79) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1
SCHEMBL25041887 0.85 CYP1A2 (0.83) CYP1A2CYP2A6CYP11B2CYP11B1HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115038706-A Compound, organic electroluminescent device and display device SK株式会社 2022-09-09 CN disclosed
EP-2013313-A1 ELECTROLUMINESCENT DEVICE INCLUDING AN ANTHRACENE DERIVATIVE EASTMAN KODAK COMPANY (US) 2009-01-14 EP disclosed
WO-2007130259-A1 ELECTROLUMINESCENT DEVICE INCLUDING AN ANTHRACENE DERIVATIVE EASTMAN KODAK COMPANY (US) 2007-11-15 WO disclosed
US-20070252517-A1 Electroluminescent device including an anthracene derivative EASTMAN KODAK COMPANY 2007-11-01 US disclosed
US-20070252517-A1 Electroluminescent device including an anthracene derivative EASTMAN KODAK COMPANY 2007-11-01 US disclosed
US-20070252517-A1 Electroluminescent device including an anthracene derivative EASTMAN KODAK COMPANY 2007-11-01 US disclosed