SCHEMBL3917456

SCHEMBL3917456

Cc1ccc(NC(=O)C2CC2)cc1-c1ccc(C(=O)Nc2ccc(CN3CCN(C(=O)OC(C)(C)C)CC3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.59
▸ MAPK14 Q16539 6/20 0.54
▸ PTPN2 P17706 1/20 0.53
▸ PTPN1 P18031 1/20 0.53
▸ PTPN6 P29350 1/20 0.53
▸ LCK P06239 4/20 0.52
▸ CSF1R P07333 4/20 0.52
▸ EGFR P00533 1/20 0.51
▸ KDR P35968 1/20 0.51
▸ ERBB4 Q15303 1/20 0.51
▸ RIN1 Q13671 1/20 0.48
▸ PRKAB2 O43741 1/20 0.47
▸ PRKAG1 P54619 1/20 0.47
▸ PRKAA2 P54646 1/20 0.47
▸ PRKAA1 Q13131 1/20 0.47
▸ PRKAG3 Q9UGI9 1/20 0.47
▸ PRKAG2 Q9UGJ0 1/20 0.47
▸ PRKAB1 Q9Y478 1/20 0.47
▸ DDR2 Q16832 1/20 0.47
▸ ACKR3 P25106 1/20 0.46

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
SCHEMBL3919974 0.88 ABL1 (0.63) ABL1MAPK14LCKCSF1REGFR
SCHEMBL2347964 0.87 ABL1 (0.65) ABL1MAPK14LCKCSF1REGFR
SCHEMBL2352219 0.86 ABL1 (0.64) ABL1MAPK14LCKCSF1REGFR
SCHEMBL3994946 0.85 ABL1 (0.52) ABL1MAPK14LCKCSF1REGFR
SCHEMBL3994955 0.85 ABL1 (0.52) ABL1MAPK14LCKCSF1REGFR
SCHEMBL14344806 0.85 ABL1 (0.62) ABL1MAPK14LCKCSF1REGFR
SCHEMBL3926179 0.84 LCK (0.54) ABL1MAPK14LCKCSF1REGFR
SCHEMBL12459047 0.84 ALDH1A1 (0.65) ABL1MAPK14LCKCSF1REGFR
SCHEMBL2346102 0.84 MAPK14 (0.65) ABL1MAPK14LCKCSF1REGFR
SCHEMBL3915262 0.83 ABL1 (0.59) ABL1MAPK14LCKCSF1REGFR

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-2038253-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C Arrow Therapeutics Limited (GB) 2009-03-25 — — EP disclosed
WO-2007138242-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2007-12-06 — — WO disclosed
WO-2007138242-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2007-12-06 — — WO disclosed
Send feedback