Benzoyl Chloride

Benzoyl Chloride

SCHEMBL4435271

COc1cc(CCc2cc(NC(=O)c3ccccc3)[nH]n2)cc(OC)c1.O=C(Cl)c1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
FGFR1 P11362 2/20 0.44
NTRK1 P04629 2/20 0.44
RET P07949 1/20 0.44
PDGFRB P09619 1/20 0.44
MARK3 P27448 1/20 0.44
TNK2 Q07912 1/20 0.44
DDR1 Q08345 1/20 0.44
MAP4K2 Q12851 1/20 0.44
MAP3K11 Q16584 1/20 0.44
DDR2 Q16832 1/20 0.44
MARK2 Q7KZI7 1/20 0.44
MAP4K3 Q8IVH8 1/20 0.44
MAP4K1 Q92918 1/20 0.44
AURKB Q96GD4 1/20 0.44

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
SCHEMBL63188 0.96 NPC1 (0.52) NPC1RAB9AHTTSMN1; SMN2MEN1
SCHEMBL62807 0.88 NPC1 (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL63568 0.85 FGFR1 (0.48) NPC1RAB9AHTTSMN1; SMN2MEN1
SCHEMBL63601 0.85 FGFR1 (0.50) NPC1RAB9AHTTSMN1; SMN2MEN1
SCHEMBL64148 0.83 KMT2A (0.54) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4553990 0.82 FGFR1 (0.46) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4430176 0.81 ABCB1 (0.57) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL64111 0.79 FGFR1 (0.56) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL64062 0.79 FGFR1 (0.55) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL62401 0.78 NR3C2 (0.48) NPC1RAB9ASMN1; SMN2KMT2ANTRK1

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-2125748-A2 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS AstraZeneca AB (SE) 2009-12-02 EP disclosed
WO-2008075068-A2 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 WO disclosed