SCHEMBL7386152

SCHEMBL7386152

CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(CC)CC)C1

nearest known ligand 0.93

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 0.93

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
SCHEMBL3514822 1.00 TACR1 (0.93) TACR1
SCHEMBL7385542 0.97 TACR1 (0.98) TACR1
SCHEMBL3516444 0.97 TACR1 (0.98) TACR1
SCHEMBL7389067 0.96 TACR1 (1.00) TACR1
SCHEMBL3515836 0.96 TACR1 (1.00) TACR1
SCHEMBL7385739 0.93 TACR1 (1.00) TACR1
SCHEMBL3514819 0.93 TACR1 (1.00) TACR1
SCHEMBL3514375 0.90 TACR1 (0.96) TACR1
SCHEMBL9222449 0.90 TACR1 (0.96) TACR1
SCHEMBL7390551 0.89 TACR1 (0.86) TACR1

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
WO-1995000498-A1 N,N-DIACYLPIPERAZINES MERCK & CO., INC. (US) 1995-01-05 WO disclosed
US-5348955-A Angiotensis II antagonists MERCK & CO., INC. (US) 1994-09-20 US disclosed
US-5292726-A N,N-diacylpiperazines MERCK & CO., INC. (US) 1994-03-08 US disclosed
WO-1992020661-A1 N, N-DIACYLPIPERAZINES MERCK & CO., INC. (US) 1992-11-26 WO disclosed