SCHEMBL9152169

SCHEMBL9152169

C[C@@H]1CCC[C@H](C)N1C(=O)CN(C(=O)CN)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
GLA P06280 1/20 0.53
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
OPRD1 P41143 1/20 0.39

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
SCHEMBL9152163 1.00 ALDH1A1 (0.53) ALDH1A1HPGDGLAKMT2AMEN1
SCHEMBL9157264 0.84 HPGD (0.46) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9157344 0.81 L3MBTL1 (0.59) ALDH1A1HPGDGLAKMT2AMEN1
SCHEMBL9157351 0.81 L3MBTL1 (0.59) ALDH1A1HPGDGLAKMT2AMEN1
SCHEMBL9154036 0.80 ALDH1A1 (0.50) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9160859 0.78 HPGD (0.55) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9158344 0.77 PLA2G1B (0.43) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9471748 0.77 SMN1; SMN2 (0.46) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9155537 0.76 OPRM1 (0.36) PKMOPRD1
SCHEMBL9152726 0.76 SMN1; SMN2 (0.44) ALDH1A1HPGDKMT2ASMN1; SMN2LMNA

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-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed