SCHEMBL4964697

SCHEMBL4964697

NC(=O)C1CCCN(S(=O)(=O)c2cccc3ccccc23)C1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.61
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
EPHX2 P34913 1/20 0.55
KDM4E B2RXH2 2/20 0.54
HSD17B10 Q99714 1/20 0.54
AKR1C3 P42330 2/20 0.50

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
SCHEMBL3974715 0.85 EPHX2 (0.65) CNR1MEN1KMT2AEPHX2
SCHEMBL25261069 0.82 EPHX2 (0.53) MEN1KMT2AEPHX2KDM4E
SCHEMBL4705021 0.82 MEN1 (0.65) CNR1MEN1KMT2AEPHX2AKR1C3
SCHEMBL610753 0.81 EPHX2 (0.67) CNR1MEN1KMT2AEPHX2
SCHEMBL610754 0.81 EPHX2 (0.67) CNR1MEN1KMT2AEPHX2
SCHEMBL7306841 0.81 AKR1C3 (0.62) CNR1MEN1KMT2AEPHX2AKR1C3
SCHEMBL4292842 0.80 EPHX2 (0.78) CNR1MEN1KMT2AEPHX2
SCHEMBL4292847 0.80 EPHX2 (0.78) CNR1MEN1KMT2AEPHX2
SCHEMBL24781390 0.80 KMT2A (0.57) MEN1KMT2A
SCHEMBL24781397 0.80 KMT2A (0.57) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758580-A4 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-16 EP claimed
EP-1758580-A2 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP claimed
WO-2006012226-A2 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO claimed
EP-4192816-A1 COMPOUNDS AS C5AR INHIBITORS Kira Pharmaceuticals (Suzhou) Ltd. (CN) 2023-06-14 EP disclosed