SCHEMBL4004236

SCHEMBL4004236

Cc1c(-c2ccccc2)[c]nc(NC=O)c1C(=O)N1CCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 2/20 0.46
KMT2A Q03164 2/20 0.45
TSHR P16473 4/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 4/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
RECQL P46063 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL4003843 0.84 KMT2A (0.46) SMN1; SMN2HTTKMT2ATSHRHPGD
SCHEMBL3759007 0.80 HTT (0.48) SMN1; SMN2HTTKMT2ATSHRUSP2
SCHEMBL3759227 0.80 HTT (0.40) SMN1; SMN2HTTKMT2AHPGDMEN1
SCHEMBL3756638 0.78 KMT2A (0.41) SMN1; SMN2HTTKMT2ATSHRHPGD
SCHEMBL3761663 0.78 KMT2A (0.49) SMN1; SMN2HTTKMT2ATSHRUSP2
SCHEMBL3765037 0.72 SIGMAR1 (0.47) SMN1; SMN2HTTKMT2ATSHRUSP2
SCHEMBL3756655 0.70 HTT (0.48) SMN1; SMN2HTTKMT2ATSHRHPGD
SCHEMBL3758808 0.68 TSHR (0.50) SMN1; SMN2HTTKMT2ATSHRHPGD
SCHEMBL3760043 0.68 SMN1; SMN2 (0.44) SMN1; SMN2HTTKMT2ATSHRUSP2
SCHEMBL3765086 0.67 TSHR (0.49) SMN1; SMN2HTTKMT2ATSHRHPGD

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
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed