SCHEMBL9724808

SCHEMBL9724808

[CH2][C@@H](Cc1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
EPHX2 P34913 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 5/20 0.48
TP53 P04637 1/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HTT P42858 1/20 0.47
CYP2D6 P10635 1/20 0.47
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
ATM Q13315 1/20 0.46

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
SCHEMBL9724829 0.90 BACE1 (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724833 0.89 LMNA (0.54) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL5037571 0.89 MAPK1 (0.63) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724978 0.89 KMT2A (0.52) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724923 0.89 RAB9A (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724967 0.86 MAPT (0.67) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724970 0.86 MAPT (0.55) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL9724950 0.85 ALDH1A1 (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9724968 0.85 KMT2A (0.65) KMT2ANPC1RAB9APOLBMAPT
SCHEMBL9724847 0.85 PKM (0.65) MEN1KMT2ANPC1RAB9AEPHX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5098934-A Enkephalinase inhibitors as analgesics or anticargcinogenic agents ROUSSEL UCLAF (FR) 1992-03-24 US claimed
US-5098934-A Enkephalinase inhibitors as analgesics or anticargcinogenic agents ROUSSEL UCLAF (FR) 1992-03-24 US disclosed