SCHEMBL7595073

SCHEMBL7595073

OCc1cc(Cl)c(Cl)c(CO)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
CASP6 P55212 1/20 0.43
ACHE P22303 2/20 0.39
MAPT P10636 2/20 0.38
HPGD P15428 7/20 0.35
HSD17B10 Q99714 6/20 0.35
TSHR P16473 5/20 0.35
CYP3A4 P08684 4/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
CASP1 P29466 1/20 0.35
RECQL P46063 2/20 0.34
S1PR1 P21453 1/20 0.34
IDO1 P14902 1/20 0.33
SHBG P04278 1/20 0.33
HSP90AA1 P07900 2/20 0.32
MAPK1 P28482 2/20 0.32
THRB P10828 2/20 0.32
NPC1 O15118 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL1965439 0.85 HPGD (0.48) KDM4ECASP6ACHEMAPTHPGD
SCHEMBL9812457 0.79 KDM4E (0.57) KDM4ECASP6ACHEMAPTHPGD
SCHEMBL5070887 0.78 ALDH1A1 (0.52) MAPTHPGDHSD17B10TSHRCYP3A4
SCHEMBL1068989 0.77 MEN1 (0.40) MEN1KMT2AKCNH2
SCHEMBL13116413 0.75 ACHE (0.42) KDM4ECASP6ACHEHPGDTSHR
SCHEMBL11331781 0.75 CYP3A4 (0.50) ACHEMAPTHPGDHSD17B10TSHR
SCHEMBL28242185 0.74 HPGD (0.33) ACHEMAPTHPGDHSD17B10TSHR
SCHEMBL1071399 0.74 NMT1 (0.34) ACHEMAPTHPGDHSD17B10TSHR
SCHEMBL3976495 0.74 ACHE (0.37) ACHEMAPTHPGDHSD17B10TSHR
SCHEMBL17414230 0.74 ACHE (0.37) ACHEMAPTHPGDHSD17B10TSHR

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-2002067882-A1 HAIR COLORANT IN THE FORM OF A CREAMY PERMANENT MOUSSE OR A STABLE FOAMED CREME COLORANT WELLA AKTIENGESELLSCHAFT (DE) 2002-09-06 WO disclosed