SCHEMBL7384697

SCHEMBL7384697

CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cc(C)cc(C)c2)C(C(=O)O)C1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 6/20 0.86

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
SCHEMBL7385826 1.00 TACR1 (0.86) TACR1
SCHEMBL7387565 0.93 TACR1 (0.85) TACR1
SCHEMBL3514906 0.93 TACR1 (1.00) TACR1
SCHEMBL7381538 0.93 TACR1 (1.00) TACR1
SCHEMBL9307683 0.90 TACR1 (0.85) TACR1
SCHEMBL7419560 0.90 TACR1 (0.85) TACR1
SCHEMBL3518039 0.89 TACR1 (0.92) TACR1
SCHEMBL7378861 0.87 TACR1 (0.83) TACR1
SCHEMBL3514055 0.87 TACR1 (0.83) TACR1
SCHEMBL3514054 0.87 TACR1 (0.83) 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