SCHEMBL8976376

SCHEMBL8976376

C/C(=C\c1ccccc1)C(=O)N1CCN(Cc2ccc(O)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
CA12 O43570 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.50
FAAH O00519 1/20 0.49
LMNA P02545 4/20 0.48
MAPK1 P28482 3/20 0.48
MAPT P10636 3/20 0.48
PKM P14618 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
HPGD P15428 3/20 0.47
GPR183 P32249 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
ALOX15 P16050 1/20 0.47
HBB P68871 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL8976380 1.00 MEN1 (0.67) MEN1KMT2ACA12CA2CA9
SCHEMBL8954085 0.92 KMT2A (0.69) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8954080 0.92 KMT2A (0.69) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976627 0.90 MEN1 (0.67) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976630 0.90 MEN1 (0.67) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976367 0.87 MEN1 (0.64) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976365 0.87 MEN1 (0.64) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976297 0.80 MEN1 (0.61) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976300 0.80 MEN1 (0.61) MEN1KMT2ASMN1; SMN2FAAHLMNA
SCHEMBL8976668 0.79 SIGMAR1 (0.58) MEN1KMT2ASMN1; SMN2FAAHLMNA

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-0707004-A1 1-Arylalcenyl 4-arylmethylpiperazinderivatives, process for their preparation and pharmaceutical composition containing them ADIR ET COMPAGNIE (FR) 1996-04-17 EP disclosed