SCHEMBL9201573

SCHEMBL9201573

O=C(N[C@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 3/20 0.68
DRD4 P21917 3/20 0.45
SLC6A12 P48065 1/20 0.45
SLC6A13 Q9NSD5 1/20 0.45
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
MCL1 Q07820 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL9206624 1.00 CCKBR (0.68) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9201582 1.00 CCKBR (0.68) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9201585 1.00 CCKBR (0.68) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9205637 1.00 CCKBR (0.68) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9206499 0.91 CCKBR (0.57) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9202433 0.91 CCKBR (0.57) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9202445 0.91 CCKBR (0.57) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9206476 0.91 CCKBR (0.57) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9202437 0.91 CCKBR (0.57) CCKBRDRD4SLC6A12SLC6A13MEN1
SCHEMBL9206819 0.87 CCKBR (0.53) CCKBRDRD4SLC6A12SLC6A13MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561941-B1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS SEARLE & CO (US) 1995-01-04 EP claimed
EP-0561941-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS. SEARLE & CO (US) 1993-09-29 EP claimed
US-5202344-A Disorders of the gastrointestinal, central nervous system and appetite regulatory systems G. D. SEARLE & CO. (US) 1993-04-13 US claimed
WO-1992010476-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS G.D. SEARLE & CO. (US) 1992-06-25 WO claimed
EP-0561941-B1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS SEARLE & CO (US) 1995-01-04 EP disclosed
US-5314886-A N-substituted lactams useful as cholecystokinin antagonists G. D. SEARLE & CO. (US) 1994-05-24 US disclosed
EP-0561941-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS. SEARLE & CO (US) 1993-09-29 EP disclosed
US-5202344-A Disorders of the gastrointestinal, central nervous system and appetite regulatory systems G. D. SEARLE & CO. (US) 1993-04-13 US disclosed
EP-0335832-B1 ARYL HYDRAZONES CIBA-GEIGY AG (CH) 1993-02-10 EP disclosed
WO-1992010476-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS G.D. SEARLE & CO. (US) 1992-06-25 WO disclosed
EP-0335832-A2 Aryl hydrazones CIBA-GEIGY AG (CH) 1989-10-04 EP disclosed