SCHEMBL14065335

SCHEMBL14065335

CCNC(=O)c1ccc2c(c1)ncn2-c1ccc(N2CCOCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.57
RAB9A P51151 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
MEN1 O00255 7/20 0.55
KMT2A Q03164 7/20 0.55
SIK1 P57059 1/20 0.55
SIK2 Q9H0K1 1/20 0.55
SIK3 Q9Y2K2 1/20 0.55
NPC1 O15118 1/20 0.53
HPGD P15428 5/20 0.52
MAPK1 P28482 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MAPK14 Q16539 1/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 3/20 0.49

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
SCHEMBL2339303 0.84 FGFR1 (0.69) TP53RAB9ASIK1SIK2SIK3
SCHEMBL2339163 0.83 FGFR1 (0.67) RAB9ASIK1SIK2SIK3HPGD
SCHEMBL1381949 0.77 KMT2A (0.61) TP53TDP1MEN1KMT2ANPC1
SCHEMBL6752611 0.76 FGFR1 (0.67) RAB9ASIK1SIK2SIK3NPC1
SCHEMBL14852489 0.75 FGFR1 (0.58) TP53RAB9ATDP1MEN1KMT2A
SCHEMBL13702280 0.74 KMO (0.63) RAB9ACYP2C9CYP2C19MAPK14ALDH1A1
SCHEMBL8773480 0.74 ALDH1A1 (0.54) TP53RAB9AKMT2ANPC1HPGD
SCHEMBL1378814 0.74 L3MBTL1 (0.58) TP53RAB9AMEN1KMT2ANPC1
SCHEMBL7982093 0.74 NAMPT (0.57) TP53RAB9ATDP1MEN1KMT2A
SCHEMBL1381806 0.73 KMT2A (0.56) TP53TDP1MEN1KMT2ANPC1

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
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed