SCHEMBL10693537

SCHEMBL10693537

Clc1cccc(Cl)c1C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
OPRL1 P41146 4/20 0.45
NPSR1 Q6W5P4 2/20 0.42
GLA P06280 1/20 0.42
HTT P42858 1/20 0.42
CEL P19835 2/20 0.41
GRM2 Q14416 1/20 0.40
TP53 P04637 2/20 0.38
ABCB1 P08183 1/20 0.38
HSD11B1 P28845 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
CYP11B2 P19099 1/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL12290554 0.93 SMN1; SMN2 (0.48) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL10387633 0.87 OPRL1 (0.49) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL3796466 0.87 CEL (0.44) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL15994822 0.86 TSHR (0.43) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL4689694 0.86 OPRL1 (0.61) SMN1; SMN2OPRL1GRM2TP53ABCB1
SCHEMBL3791245 0.86 TSHR (0.41) SMN1; SMN2OPRL1NPSR1GLAHTT
Cyclopropane SCHEMBL28426089 0.86 HTR2A (0.46) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL3791971 0.85 CEL (0.43) SMN1; SMN2OPRL1NPSR1GLAHTT
SCHEMBL20606723 0.83 OPRL1 (0.60) SMN1; SMN2OPRL1TP53ABCB1MEN1
SCHEMBL11751246 0.83 TSHR (0.45) SMN1; SMN2OPRL1NPSR1GLAHTT

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
EP-0266662-A2 Process for the preparation of poly(arylensulphides) with lower crystallization temperature BAYER AG (DE) 1988-05-11 EP disclosed