SCHEMBL6598145

SCHEMBL6598145

Fc1ccc(-c2nn3cc(Cl)ccc3c2Br)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.63
CSNK1D P48730 3/20 0.43
CSNK1A1 P48729 2/20 0.43
CSNK1E P49674 2/20 0.43
AHR P35869 2/20 0.39
SRC P12931 2/20 0.36
BRAF P15056 2/20 0.36
KDR P35968 2/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 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
SCHEMBL7841690 0.88 MAPK14 (0.51) MAPK14CSNK1DCSNK1A1CSNK1EAHR
SCHEMBL6592866 0.84 MAPK14 (0.45) MAPK14AHRNPC1RAB9AKMT2A
SCHEMBL6594341 0.83 MAPK14 (0.45) MAPK14SMN1; SMN2KMT2A
SCHEMBL7841227 0.83 MAPK14 (0.60) MAPK14CSNK1DCSNK1A1CSNK1EPTGS2
SCHEMBL5398429 0.82 MAPK14 (0.63) MAPK14CSNK1DCSNK1A1CSNK1EAHR
SCHEMBL5364802 0.81 MAPK14 (0.66) MAPK14CSNK1DCSNK1A1CSNK1EAHR
SCHEMBL5396092 0.78 MAPK14 (0.65) MAPK14CSNK1DCSNK1A1CSNK1EAHR
SCHEMBL6593792 0.78 CACNA2D1 (0.43) MAPK14TP53TSHRPTGS2
SCHEMBL5379814 0.75 MAPK14 (0.61) MAPK14GABRPGABRDGABRA1GABRB1
SCHEMBL18198762 0.74 GRIA1 (0.48) MAPK14CSNK1DCSNK1A1CSNK1EMAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1157025-B1 PYRAZOLOPYRIDINES GLAXO GROUP LTD (GB) 2004-03-10 EP disclosed
US-6498166-B1 POTENT AND SELECTIVE INHIBITORS OF CYCLOOXYGENASE-2; TREATING PAIN, FEVER AND INFLAMMATION SMITHKLINE BEECHAM CORPORATION 2002-12-24 US disclosed