SCHEMBL9504583

SCHEMBL9504583

CC(C)n1ccc2cc(O)c(O)cc21.Oc1cc2cc[nH]c2cc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
RAD51 Q06609 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GPR84 Q9NQS5 1/20 0.34
PTGS2 P35354 1/20 0.33
GUSB P08236 1/20 0.33
MAPT P10636 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
ENPP2 Q13822 2/20 0.31
CSNK2A1 P68400 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL25913211 0.86 GPR84 (0.39) TYRUSP2GAAALOX15RAD51
SCHEMBL9108868 0.84 ACHE (0.36) USP2ALOX15PTGS2MAPTCYP1A2
SCHEMBL31375356 0.76 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL31375351 0.76 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL28298713 0.76 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL48994 0.76 TYR (0.58) TYRUSP2GAAALOX15RAD51
Bromide SCHEMBL29769307 0.74 TYR (0.56) TYRUSP2GAAALOX15RAD51
Hydrochloric Acid SCHEMBL4625112 0.74 TYR (0.56) TYRUSP2GAAALOX15RAD51
Bromide SCHEMBL27546379 0.74 TYR (0.56) TYRUSP2GAAALOX15RAD51
SCHEMBL9506012 0.71 MAPT (0.34) TYRUSP2GAAALOX15RAD51

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
EP-0335477-B1 THE USE OF N-SUBSTITUTED-5,6-DIHYDROXYINDOLES AS A HAIR COLORING AGENT Bristol-Myers Squibb Company (US) 1993-07-21 EP claimed