SCHEMBL11324913

SCHEMBL11324913

Oc1cc(Cl)c(-c2nc3ccccc3o2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM6B O15054 1/20 0.55
KDM6A O15550 1/20 0.55
PTGS2 P35354 2/20 0.55
ESR1 P03372 4/20 0.51
ESR2 Q92731 4/20 0.51
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
MAPT P10636 4/20 0.46
TP53 P04637 3/20 0.46
HSD17B10 Q99714 3/20 0.46
KDM4E B2RXH2 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PKM P14618 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HCRTR1 O43613 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46

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
SCHEMBL9508846 0.83 NPC1 (0.51) KDM6BKDM6APTGS2RAB9ANPC1
SCHEMBL11326031 0.81 KDM6B (0.55) KDM6BKDM6APTGS2RAB9ANPC1
SCHEMBL11326079 0.77 PTGS2 (0.62) KDM6BKDM6APTGS2ESR1ESR2
SCHEMBL29531707 0.76 NPC1 (0.69) KDM6BKDM6ARAB9ANPC1ALDH1A1
SCHEMBL824375 0.76 NPC1 (0.69) KDM6BKDM6ARAB9ANPC1ALDH1A1
SCHEMBL12861182 0.76 PTGS2 (0.60) KDM6BKDM6APTGS2ESR1ESR2
SCHEMBL5831992 0.75 PTGS2 (0.80) KDM6BKDM6APTGS2ESR1ESR2
SCHEMBL24155763 0.75 SMN1; SMN2 (0.58) PTGS2RAB9ANPC1ALDH1A1HPGD
SCHEMBL22023371 0.75 SMN1; SMN2 (0.58) PTGS2RAB9ANPC1ALDH1A1HPGD
SCHEMBL1296601 0.74 KDM6B (0.78) KDM6BKDM6APTGS2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4256626-A 2-BENZIMIDAZOLYL-, 2-BENZOTHIAZOLYL-, OR 2-INDOLYL-PHENYL DERIVATIVES LINKED TO A 2-HYDROXYBENZOPHENONE EASTMAN KODAK COMPANY (US) 1981-03-17 US disclosed
US-4174321-A POLYMERIC MOLDING MATERIALS EASTMAN KODAK COMPANY (US) 1979-11-13 US disclosed
US-4127501-A BENZOXAZOLE, BENZOTHIAZOLE, BENZIMIDAZOLE, BENZOTRIAZOLE OR INDOLE DERIVATIVES EASTMAN KODAK COMPANY (US) 1978-11-28 US disclosed
US-4115348-A DEGRADATION INHIBITORS EASTMAN KODAK COMPANY (US) 1978-09-19 US disclosed