SCHEMBL19506399

SCHEMBL19506399

Oc1cc2cc[nH]c2cc1OS

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.46
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
RAD51 Q06609 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPR84 Q9NQS5 1/20 0.42
ENPP2 Q13822 2/20 0.38
CSNK2A1 P68400 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
BACE1 P56817 2/20 0.37
AHR P35869 6/20 0.37
NR4A2 P43354 2/20 0.37
CYP2A6 P11509 1/20 0.37
CMA1 P23946 1/20 0.37
F7 P08709 1/20 0.37
LTA4H P09960 1/20 0.37

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
SCHEMBL19506397 0.93 TYR (0.46) TYRUSP2GAAALOX15RAD51
SCHEMBL1959555 0.81 POLB (0.50) TYRUSP2GAAALOX15RAD51
SCHEMBL31375356 0.78 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL48994 0.78 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL31375351 0.78 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL28298713 0.78 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL9736712 0.77 CYP2A6 (0.42) TYRUSP2GAAALOX15RAD51
SCHEMBL15953327 0.77 PTK6 (0.45) TYRUSP2GAAALOX15RAD51
SCHEMBL15952270 0.77 GPR84 (0.43) TYRUSP2GAAALOX15RAD51
SCHEMBL9735891 0.77 TYR (0.42) 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
WO-2017182340-A1 USE OF O-GLYCOSYLATED INDOLE OR INDOLINE DERIVATIVE WITH GLYCOSIDASE FOR DEYING KERATIN FIBERS L'OREAL (FR) 2017-10-26 WO disclosed