SCHEMBL9137241

SCHEMBL9137241

CCc1nc2c(C)cc(C)nc2n1Cc1ccc2nn(-c3ccccc3-c3nnn[nH]3)c(Cl)c2c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.51
AGTR2 P50052 2/20 0.51
GPR4 P46093 2/20 0.47
PPARG P37231 1/20 0.45

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
SCHEMBL9135835 0.91 AGTR1 (0.49) AGTR1AGTR2GPR4PPARG
SCHEMBL9135966 0.84 AGTR1 (0.43) AGTR1AGTR2GPR4
SCHEMBL8913647 0.83 AGTR1 (0.52) AGTR1AGTR2GPR4
L-158809 SCHEMBL683357 0.81 AGTR2 (0.71) AGTR1AGTR2GPR4
L-158809 SCHEMBL7944169 0.80 AGTR2 (0.70) AGTR1AGTR2GPR4
SCHEMBL9136007 0.80 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL8914997 0.80 AGTR1 (0.53) AGTR1AGTR2GPR4PPARG
SCHEMBL8741166 0.78 AGTR2 (0.61) AGTR1AGTR2GPR4PPARG
SCHEMBL9426957 0.77 AGTR1 (0.51) AGTR1AGTR2GPR4PPARG
SCHEMBL9318225 0.76 AGTR1 (0.51) AGTR1AGTR2GPR4PPARG

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-5387684-A For treatment and prophylaxis of angiotensin II-mediated diseases such as circulatory diseases of hypertension and heart failure THE GREEN CROSS CORPORATION (JP) 1995-02-07 US disclosed
EP-0602246-A1 ISOINDAZOLE COMPOUND THE GREEN CROSS CORPORATION (JP) 1994-06-22 EP disclosed