SCHEMBL7500902

SCHEMBL7500902

Cc1nc(-c2ccccc2)nc(N2CCCC2C(=O)N2CC(C)NC(C)C2)c1C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.39
HSD11B1 P28845 9/20 0.37
AADAT Q8N5Z0 1/20 0.37
MLNR O43193 1/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.36
GRM5 P41594 2/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL7500897 1.00 GHSR (0.39) GHSRHSD11B1AADATMLNRKMT2A
SCHEMBL7499026 0.83 KMT2A (0.48) AADATKMT2ALMNAMAPTMEN1
SCHEMBL7499021 0.83 KMT2A (0.48) AADATKMT2ALMNAMAPTMEN1
SCHEMBL7501902 0.75 FKBP1A (0.46) AADATMAPT
SCHEMBL7498358 0.73 UCHL1 (0.39) HSD11B1AADAT
SCHEMBL7506786 0.70 POLQ (0.39) LMNAMAPT
SCHEMBL7495012 0.69 PDE4B (0.46) LMNA
SCHEMBL7505924 0.67 UCHL1 (0.42) KMT2AMAPTMEN1
SCHEMBL4078297 0.66 MAT2A (0.47) KMT2ALMNAMAPT
SCHEMBL4084126 0.66 MAT2A (0.47) KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826673-B1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO (JP) 2002-11-20 EP disclosed
US-5972946-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0826673-A1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 EP disclosed