SCHEMBL7407232

SCHEMBL7407232

O=C(Nc1ccccc1)N1CCC(C(NCCc2ccccc2)c2ccc(F)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.51
KMT2A Q03164 4/20 0.48
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
ALOX15 P16050 1/20 0.47
NPC1 O15118 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
SCHEMBL7416706 0.89 KMT2A (0.47) KMT2AMEN1
SCHEMBL7415265 0.83 GLA (0.54) FAAHKMT2AMEN1GLANPC1
SCHEMBL7411614 0.77 GAA (0.53) KMT2AMEN1
SCHEMBL7409332 0.76 SLC6A3 (0.41)
SCHEMBL7409826 0.72 ALDH1A1 (0.46) KMT2AMEN1ALOX15
SCHEMBL7411767 0.72 HTR2A (0.59)
SCHEMBL7322620 0.71 KDM4E (0.61) FAAHKMT2AMEN1NPC1
SCHEMBL23848213 0.70 CYP1A2 (0.54) FAAHKMT2AGLANPC1
SCHEMBL8252174 0.70 ALDH1A1 (0.63) FAAHNPC1
SCHEMBL3600315 0.69 FAAH (1.00) FAAHKMT2AMEN1

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-5198449-A N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents A. H. ROBINS COMPANY INCORPORATED (US) 1993-03-30 US disclosed