SCHEMBL4295308

SCHEMBL4295308

CN1CCCN(c2cc3[nH]c(-c4n[nH]cc4NC(N)=O)nc3cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.42
KDR P35968 3/20 0.42
FGFR2 P21802 1/20 0.42
FGFR3 P22607 1/20 0.42
CSF1R P07333 2/20 0.37
PDGFRB P09619 2/20 0.37
OPRL1 P41146 1/20 0.37
KCNH2 Q12809 4/20 0.36
SCN5A Q14524 1/20 0.36
FLT3 P36888 1/20 0.36
FLT1 P17948 1/20 0.36
ATR Q13535 1/20 0.36
SRPK1 Q96SB4 1/20 0.35
ACHE P22303 1/20 0.35
PRKCZ Q05513 3/20 0.35
EGLN1 Q9GZT9 1/20 0.35
CDK2 P24941 2/20 0.34

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
SCHEMBL3934348 0.89 FGFR1 (0.40) FGFR1KDRFGFR2FGFR3OPRL1
SCHEMBL4129225 0.88 SYK (0.44) FGFR1KDRFGFR2FGFR3OPRL1
SCHEMBL4124997 0.88 FGFR1 (0.41) FGFR1KDRFGFR2FGFR3PDGFRB
SCHEMBL3932241 0.86 FGFR1 (0.42) FGFR1KDRFGFR2FGFR3OPRL1
Trifluoroacetic Acid SCHEMBL4133711 0.85 FGFR1 (0.38) FGFR1KDRFGFR2FGFR3OPRL1
SCHEMBL18833424 0.84 FGFR1 (0.46) FGFR1KDRFGFR2FGFR3CSF1R
Trifluoroacetic Acid SCHEMBL4138498 0.83 SYK (0.41) FGFR1KDRFGFR2FGFR3OPRL1
SCHEMBL4129282 0.83 FGFR1 (0.43) FGFR1KDRFGFR2FGFR3CSF1R
SCHEMBL3928874 0.83 SYK (0.46) FGFR1KDRFGFR2FGFR3CSF1R
SCHEMBL18833148 0.83 FGFR1 (0.42) FGFR1KDRFGFR2FGFR3OPRL1

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-2041119-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF Aventis Pharma S.A. (FR) 2009-04-01 EP disclosed
WO-2008003857-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2008-01-10 WO disclosed