SCHEMBL7186370

SCHEMBL7186370

CCOc1ccc(C(c2ccc(Cl)cc2)c2cncn2C)cc1C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.45
FNTB P49356 4/20 0.45
FFAR1 O14842 1/20 0.37
SCN4A P35499 1/20 0.37
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
CXCR3 P49682 3/20 0.36
RORC P51449 3/20 0.36
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL4280884 0.69 FNTA (0.78) FNTAFNTB
SCHEMBL18754515 0.68 FNTA (0.53) FNTAFNTBRORC
SCHEMBL254428 0.68 HPGD (0.53) SCN4ANPSR1
SCHEMBL11357003 0.67 TAS1R3 (0.42) FFAR1SCN4A
SCHEMBL5089019 0.66 HRH3 (0.43) FNTAFNTB
SCHEMBL4378944 0.66 FNTA (0.49) FNTAFNTB
SCHEMBL10932267 0.66 TAS1R3 (0.42) FFAR1RORC
SCHEMBL7759203 0.66 SLC2A1 (0.46)
SCHEMBL5778239 0.65 FNTA (0.68) FNTAFNTB
SCHEMBL25621298 0.65 TAS1R3 (0.45) FFAR1

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-1267872-A2 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH ANTI-TUMOR ANTHRACYCLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-01-02 EP disclosed
WO-2001064197-A2 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH ANTI-TUMOR ANTHRACYCLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2001-09-07 WO disclosed