SCHEMBL3996329

SCHEMBL3996329

Clc1cn[c]c(-c2ccccc2)c1N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.42
HTT P42858 1/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.40
HSD17B10 Q99714 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
TSHR P16473 3/20 0.40
MAPT P10636 2/20 0.40
CASP1 P29466 2/20 0.40
AR P10275 3/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PIK3CA P42336 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL3754803 0.75 NCF1 (0.44) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3763677 0.72 PDE4A (0.46) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3770950 0.71 KMT2A (0.48) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3763028 0.70 LMNA (0.35) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3760258 0.70 HTT (0.38) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3757772 0.69 HSD17B10 (0.40) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL8664845 0.67 LMNA (0.43) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL6814073 0.67 HTT (0.44) HTTALDH1A1LMNAHSD17B10NPSR1
SCHEMBL3759709 0.67 NPY5R (0.32) ALDH1A1HSD17B10TSHRMAPK1NPC1
SCHEMBL3998045 0.67 ADRB1 (0.43) ALDH1A1TSHRHPGD

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