SCHEMBL8791998

SCHEMBL8791998

BrCc1ccc(-c2ccsc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.40
AGTR2 P50052 1/20 0.40
KMT2A Q03164 1/20 0.32
PTGS1 P23219 1/20 0.32
AGT P01019 2/20 0.32
PTGS2 P35354 1/20 0.31

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
SCHEMBL8791377 0.86 AGTR1 (0.40) AGTR1AGTR2KMT2AAGTPTGS2
SCHEMBL796 0.85 AGTR1 (0.50) AGTR1AGTR2AGT
SCHEMBL29404889 0.85 AGTR1 (0.50) AGTR1AGTR2AGT
SCHEMBL7196989 0.83 AGTR1 (0.41) AGTR1AGTR2PTGS2
SCHEMBL7384556 0.82 AGTR1 (0.42) AGTR1AGTR2AGT
SCHEMBL9587058 0.82 AGTR1 (0.40) AGTR1AGTR2AGT
SCHEMBL8791472 0.78 AGTR1 (0.40) AGTR1AGTR2AGT
SCHEMBL9033026 0.78 AGTR1 (0.38) AGTR1PTGS1PTGS2
SCHEMBL10299418 0.77 POLB (0.39) AGTR1AGTR2KMT2A
SCHEMBL29931185 0.77 AGTR1 (0.44) AGTR1AGTR2AGT

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
EP-0652869-B1 IMIDAZOLE ETHERS HAVING A II ANTAGONIST ACTIVITY LUSO FARMACO INST (IT) 1997-03-26 EP disclosed
US-5538987-A Imidazole ethers having a II antagonist activity ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1996-07-23 US disclosed
EP-0652869-A1 IMIDAZOLE ETHERS HAVING A II ANTAGONIST ACTIVITY. LUSO FARMACO INST (IT) 1995-05-17 EP disclosed
WO-1994002467-A1 IMIDAZOLE ETHERS HAVING A II ANTAGONIST ACTIVITY INSTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1994-02-03 WO disclosed