SCHEMBL7339673

SCHEMBL7339673

Cc1ccc(CN(C(=O)CN2CCN(C)CC2)c2ccc(N)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.43
TSHR P16473 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CNR2 P34972 2/20 0.43
OPRM1 P35372 1/20 0.42
CNR1 P21554 1/20 0.42
ALPL P05186 1/20 0.40
PTBP1 P26599 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40

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
SCHEMBL7340750 0.89 MEN1 (0.45) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL7340970 0.88 CNR2 (0.56) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL7342337 0.88 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL7342306 0.88 MEN1 (0.56) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL7341561 0.87 RNF4 (0.46) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL7340748 0.86 HDAC1 (0.51) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL7346461 0.86 OPRM1 (0.53) MEN1KMT2AALDH1A1OPRM1
SCHEMBL7341892 0.81 LMNA (0.54) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL7347840 0.81 MAPT (0.50) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL7341990 0.80 ALDH1A1 (0.59) LMNAMEN1KMT2AALDH1A1KDM4E

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-0585500-A1 Diaryl piperazineacetamides as antimuscarinic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1994-03-09 EP disclosed