SCHEMBL8902160

SCHEMBL8902160

Cc1cccc(CCBr)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
TRPA1 O75762 2/20 0.46
GABRA1 P14867 3/20 0.41
GABRB2 P47870 3/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
IAPP P10997 3/20 0.39
TAAR1 Q96RJ0 1/20 0.38
ATM Q13315 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL28303106 0.84 GABRA1 (0.50) ALDH1A1GABRA1GABRB2CA1CA2
SCHEMBL8900882 0.83 ALDH1A1 (0.56) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL1917835 0.81 ALDH1A1 (0.54) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL1005722 0.81 ALDH1A1 (0.54) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL8400520 0.81 ALDH1A1 (0.54) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL9513545 0.79 ALDH1A1 (0.52) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL11785077 0.79 ALDH1A1 (0.52) ALDH1A1TRPA1GABRA1GABRB2CA12
SCHEMBL29712516 0.78 ESR1 (0.42) ALDH1A1TRPA1GABRA1GABRB2CA1
SCHEMBL10933913 0.78 ESR1 (0.42) ALDH1A1TRPA1GABRA1GABRB2CA1
SCHEMBL27505072 0.78 ALDH1A1 (0.56) ALDH1A1TRPA1GABRA1GABRB2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5700897-A Method for making fluorescent polymers OPTICAL SENSORS INCORPORATED (US) 1997-12-23 US disclosed
US-5480723-A Surface-bound fluorescent polymers and related methods of synthesis and use OPTICAL SENSORS INCORPORATED (US) 1996-01-02 US disclosed
US-5354825-A Surface-bound fluorescent polymers and related methods of synthesis and use KLAINER STANLEY M (US) 1994-10-11 US disclosed
WO-1988005533-A1 AMPLIFICATION OF SIGNALS FROM OPTICAL FIBERS KELSIUS, INC. (US) 1988-07-28 WO disclosed