SCHEMBL7320487

SCHEMBL7320487

CCCc1nc2ccnn2c(Cl)c1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.41

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
SCHEMBL9260598 0.90 SLC33A1 (0.45)
SCHEMBL7315139 0.90
SCHEMBL7319381 0.89
SCHEMBL9261174 0.85
Hydrochloric Acid SCHEMBL7317120 0.83 SLC33A1 (0.40) AGTR1
Pyrrolidine SCHEMBL7313042 0.83 HTR2A (0.41)
SCHEMBL9255550 0.82 SLC33A1 (0.42)
Morpholine SCHEMBL7319945 0.82 HTR2A (0.41)
SCHEMBL9262460 0.81 AGTR1 (0.39) AGTR1
SCHEMBL7313030 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5389632-A Cardiovascular disorders LABORATOIRES UPSA (FR) 1995-02-14 US disclosed
US-5231094-A Cardiovascular disorders SOCIETE ANONYME: LABORATOIRES UPSA (FR) 1993-07-27 US disclosed