SCHEMBL3737684

SCHEMBL3737684

CCNn1c(=O)ccc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.53
CA9 Q16790 2/20 0.53
BRD4 O60885 1/20 0.53
BRPF1 P55201 1/20 0.53
KAT2B Q92831 1/20 0.53
BRD9 Q9H8M2 1/20 0.53
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 4/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 2/20 0.36
CDK4 P11802 2/20 0.34
CCND1 P24385 2/20 0.34
NOTUM Q6P988 1/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.33

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
SCHEMBL6436320 0.88 CA12 (0.49) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1052534 0.86 CA12 (0.47) CA12CA9BRD4BRPF1KAT2B
SCHEMBL3733975 0.84 CA12 (0.49) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1052536 0.83 KAT2B (0.47) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1052760 0.81 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL3728433 0.80 KAT2B (0.45) CA12CA9BRD4BRPF1KAT2B
SCHEMBL17910185 0.78 CDK4 (0.39) CA12CA9BRD4BRPF1KAT2B
SCHEMBL3735606 0.76 ALDH1A1 (0.40) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1050118 0.75 BRD4 (0.40) CA12CA9BRD4BRPF1KAT2B
SCHEMBL3728484 0.75 SMN1; SMN2 (0.43) CA12CA9BRD4BRPF1KAT2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed