SCHEMBL7580262

SCHEMBL7580262

Oc1cc2cc[nH]c2cc1O.[O-][Br+2]([O-])O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.48
USP2 O75604 1/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
RAD51 Q06609 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GPR84 Q9NQS5 1/20 0.45
GUSB P08236 1/20 0.41
ENPP2 Q13822 2/20 0.40
CSNK2A1 P68400 1/20 0.40
AHR P35869 6/20 0.39
CYP2A6 P11509 3/20 0.39
NR4A2 P43354 2/20 0.39
CMA1 P23946 1/20 0.39
F7 P08709 1/20 0.39
LTA4H P09960 1/20 0.39
F3 P13726 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL31375356 0.89 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL48994 0.89 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL28298713 0.89 TYR (0.58) TYRUSP2GAAALOX15RAD51
SCHEMBL31375351 0.89 TYR (0.58) TYRUSP2GAAALOX15RAD51
Bromide SCHEMBL29769307 0.87 TYR (0.56) TYRUSP2GAAALOX15RAD51
Bromide SCHEMBL27546379 0.87 TYR (0.56) TYRUSP2GAAALOX15RAD51
Hydrochloric Acid SCHEMBL4625112 0.87 TYR (0.56) TYRUSP2GAAALOX15RAD51
Bicarbonate SCHEMBL4385266 0.82 ENPP2 (0.53) TYRUSP2GAAALOX15RAD51
Catechol SCHEMBL7624422 0.82 ALOX15 (0.50) TYRUSP2GAAALOX15RAD51
Sulfuric Acid SCHEMBL9312939 0.80 TYR (0.48) 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-1240890-A1 HAIR DYE COMPOSITION Lion Corporation (JP) 2002-09-18 EP disclosed