SCHEMBL6969797

SCHEMBL6969797

CCOC(=O)CN1C(=O)CCN(C(=O)c2ccc(N)cc2)c2cc(C)c(C)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 1/20 0.43
HTT P42858 2/20 0.43
USP2 O75604 1/20 0.43
PPARG P37231 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAOA P21397 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AVPR2 P30518 1/20 0.38
AVPR1A P37288 1/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
PIN1 Q13526 1/20 0.38

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
SCHEMBL6970661 0.90 ALDH1A1 (0.46) LMNANPSR1HTTUSP2PPARG
SCHEMBL6969459 0.90 ALDH1A1 (0.46) LMNANPSR1HTTUSP2PPARG
SCHEMBL6960127 0.88 NPSR1 (0.49) LMNANPSR1HTTUSP2PPARG
SCHEMBL6969382 0.88 LMNA (0.55) LMNANPSR1HTTUSP2PPARG
SCHEMBL6962852 0.87 CA1 (0.43) LMNANPSR1HTTUSP2PPARG
SCHEMBL6969348 0.86 SMN1; SMN2 (0.45) LMNANPSR1HTTUSP2PPARG
SCHEMBL6967645 0.86 LOXL2 (0.40) LMNANPSR1HTTUSP2PPARG
SCHEMBL6968111 0.81 ALDH1A1 (0.43) LMNANPSR1HTTUSP2MEN1
SCHEMBL6964164 0.81 NPSR1 (0.46) LMNANPSR1HTTUSP2MEN1
SCHEMBL6960505 0.80 LMNA (0.52) LMNANPSR1HTTUSP2PPARG

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-0620216-B1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2003-01-08 EP disclosed
US-5521170-A VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-28 US disclosed
EP-0620216-A1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed