SCHEMBL6656641

SCHEMBL6656641

CCc1cccc(Cl)c1[O]

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.46
GABRB2 P47870 4/20 0.46
PNMT P11086 2/20 0.43
IDO1 P14902 3/20 0.39
TAAR1 Q96RJ0 4/20 0.39
HTR1A P08908 2/20 0.38
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
DRD3 P35462 2/20 0.38
ALDH1A1 P00352 1/20 0.37
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
CSNK2A3 Q8NEV1 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
SCHEMBL28313100 0.85 TAAR1 (0.39) GABRA1GABRB2PNMTIDO1TAAR1
SCHEMBL199729 0.82 GABRA1 (0.57) GABRA1GABRB2TAAR1HTR1A
SCHEMBL91279 0.78 PNMT (0.62) GABRA1GABRB2PNMTIDO1TAAR1
SCHEMBL91282 0.77
SCHEMBL30633058 0.77
SCHEMBL3790392 0.76 GABRA1 (0.46) GABRA1GABRB2PNMTIDO1TAAR1
SCHEMBL3789998 0.76 ALDH1A1 (0.48) GABRA1GABRB2PNMTIDO1ALDH1A1
SCHEMBL330593 0.76
SCHEMBL11652064 0.75 IDO1 (0.54) GABRA1GABRB2PNMTIDO1TAAR1
Ammonia Solution, Strong SCHEMBL266446 0.75 IDO1 (0.54) GABRA1GABRB2PNMTIDO1TAAR1

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
EP-0833203-B1 Anthraquinone compounds NIPPON CATALYTIC CHEM IND (JP) 2004-06-16 EP disclosed
US-5968688-A RESINS AND DYES FOR COLOR FILTERS NIPPON SHOKUBAI CO., LTD. (JP) 1999-10-19 US disclosed
EP-0833203-A1 Color filter grade photosensitive resin coloring composition, and color filter using the same NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-01 EP disclosed