SCHEMBL6508873

SCHEMBL6508873

Nc1c(-c2ccccc2)oc2ccc(O)cc2c1=O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 1/20 0.68
▸ RAB9A P51151 3/20 0.62
▸ KDM4E B2RXH2 7/20 0.60
▸ MAPT P10636 5/20 0.60
▸ MEN1 O00255 5/20 0.60
▸ KMT2A Q03164 5/20 0.60
▸ CYP3A4 P08684 4/20 0.60
▸ HSD17B10 Q99714 4/20 0.60
▸ CYP2C9 P11712 2/20 0.60
▸ DHFR P00374 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ KCNH2 Q12809 1/20 0.59
▸ ALOX15 P16050 2/20 0.57
▸ CASP1 P29466 1/20 0.57
▸ CASP7 P55210 1/20 0.57
▸ MAOA P21397 1/20 0.56
▸ CALM1 P0DP23 2/20 0.55
▸ PKM P14618 2/20 0.55
▸ NPC1 O15118 2/20 0.55
▸ FTO Q9C0B1 1/20 0.55

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
SCHEMBL15456750 0.85 CYP3A4 (0.82) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL1627936 0.85 CYP3A4 (0.82) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL27940000 0.82 ADORA3 (0.74) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL27940011 0.82 KDM4E (0.60) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL27405000 0.82 CYP3A4 (0.79) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL622846 0.81 DDR2 (1.00) DDR2RAB9AKDM4EMAPTMEN1
SCHEMBL7162949 0.79 KDM4E (0.74) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL5130608 0.77 MAPT (0.70) DDR2RAB9AKDM4EMAPTMEN1
SCHEMBL29167450 0.76 KDM4E (0.56) RAB9AKDM4EMAPTMEN1KMT2A
SCHEMBL3537369 0.76 RAB9A (0.78) RAB9AKDM4EMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005107760-A1 COMPOUNDS AND COMPOSITIONS AS INDUCERS OF KERATINOCYTE DIFFERENTIATION IRM LLC (BM) 2005-11-17 — — WO disclosed
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