SCHEMBL4047810

SCHEMBL4047810

[CH2]C(=O)N1CCC(N)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43
CHRM2 P08172 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
CACNA1B Q00975 2/20 0.36
DPP4 P27487 6/20 0.33
PARP1 P09874 2/20 0.32
PARP2 Q9UGN5 2/20 0.32
DPP7 Q9UHL4 2/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 2/20 0.30
NPC1 O15118 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30

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
SCHEMBL1136825 0.79 GNAI3 (0.46) GNAI3GNAO1GNAI1CHRM2CHRM1
SCHEMBL505101 0.77 GPR119 (0.37) CHRM2CHRM1CHRM3DPP4DPP7
SCHEMBL1517004 0.77 GNAI3 (0.44) GNAI3GNAO1GNAI1CHRM2CHRM1
Hydrochloric Acid SCHEMBL1136694 0.77 GNAI3 (0.48) GNAI3GNAO1GNAI1CHRM2CHRM1
Hydrochloric Acid SCHEMBL1136691 0.77 GNAI3 (0.48) GNAI3GNAO1GNAI1CHRM2CHRM1
SCHEMBL112479 0.77 GNAI3 (0.44) GNAI3GNAO1GNAI1CHRM2CHRM1
SCHEMBL4757619 0.76 GAA (0.53) CHRM1GAAALDH1A1TSHR
SCHEMBL10128163 0.75 GNAI3 (0.43) GNAI3GNAO1GNAI1CHRM2CHRM1
Hydrochloric Acid SCHEMBL3286216 0.75 GNAI3 (0.47) GNAI3GNAO1GNAI1CHRM2CHRM1
Hydrochloric Acid SCHEMBL4120587 0.75 GNAI3 (0.47) GNAI3GNAO1GNAI1CHRM2CHRM1

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-2029570-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-04 EP disclosed
WO-2007141504-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2007-12-13 WO disclosed