SCHEMBL8973308

SCHEMBL8973308

Clc1ccc(Cc2c[nH]c(-c3ccccc3)n2)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CXCR2 P25025 1/20 0.41
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MAPK13 O15264 1/20 0.39
RAF1 P04049 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
PNP P00491 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
RNASEH1 O60930 1/20 0.37
PGR P06401 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
SCHEMBL8973626 0.84 GABRA1 (0.55) GABRA1GABRB2MAPK1CXCR2PSD
SCHEMBL17622 0.81 CXCR2 (0.42) GABRA1GABRB2TDP1CXCR2PSD
Hydrochloric Acid SCHEMBL8588873 0.80 CXCR2 (0.41) GABRA1GABRB2TDP1CXCR2PSD
SCHEMBL3844900 0.78 GABRA1 (0.48) GABRA1GABRB2TSHRMAPK1TDP1
SCHEMBL8973180 0.78 NR1H2 (0.43) GABRA1GABRB2TSHRMAPK1CXCR2
SCHEMBL28783020 0.78 TAAR1 (0.47) GABRA1GABRB2TDP1CXCR2
SCHEMBL8973406 0.78 L3MBTL1 (0.40) GABRA1GABRB2ADORA2AADORA1PNP
SCHEMBL17279789 0.77 SMN1; SMN2 (0.42) GABRA1GABRB2TDP1CXCR2PSD
SCHEMBL8973353 0.77 MAPT (0.43) GABRA1GABRB2MAPK1TDP1SIGMAR1
SCHEMBL10764555 0.76 IDO1 (0.43) TSHRMAPK1TDP1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5560785-A TREATING SURFACE WITH SOLUTION OF IMIDAZOLE COMPOUND, COPPER COMPOUND, ZINC COMPOUND, STABILIZERS SHIKOKU CHEMICALS CORPORATION (JP) 1996-10-01 US disclosed
US-5498301-A ON A PRINTED WIRING BOARD, HEAT RESISTANT, MOISTURE RESISTANT, A 2-ARYLIMIDAZOLE, CARBOXYLIC ACID, AMMONIA, WATER SHIKOKU CHEMICALS CORPORATION (JP) 1996-03-12 US disclosed
EP-0627499-A1 Agent for treating surfaces of copper and copper alloys SHIKOKU CHEMICALS CORPORATION (JP) 1994-12-07 EP disclosed