SCHEMBL9851487

SCHEMBL9851487

CCCc1nc2cccnc2n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.63
AGTR2 P50052 6/20 0.63
AGT P01019 2/20 0.53
ENPP2 Q13822 2/20 0.45
TP53 P04637 1/20 0.45
LMNA P02545 1/20 0.45
PPARG P37231 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44

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
SCHEMBL9854421 0.95 AGTR1 (0.62) AGTR1AGTR2AGTENPP2
SCHEMBL9851481 0.93 AGTR1 (0.54) AGTR1AGTR2AGTENPP2TP53
SCHEMBL9851456 0.88 AGTR1 (0.52) AGTR1AGTR2AGTENPP2TP53
SCHEMBL9851417 0.88 AGTR1 (0.63) AGTR1AGTR2AGTPPARG
SCHEMBL9851410 0.87 AGTR1 (0.64) AGTR1AGTR2AGTPPARG
SCHEMBL9402017 0.87 AGTR1 (0.69) AGTR1AGTR2AGTPPARGPDE4A
SCHEMBL9851503 0.86 AGTR1 (0.60) AGTR1AGTR2AGTPPARG
SCHEMBL9851446 0.86 AGTR1 (0.60) AGTR1AGTR2AGTPPARG
SCHEMBL9851527 0.85 AGTR1 (0.60) AGTR1AGTR2AGTPPARG
SCHEMBL9702222 0.84 AGTR1 (0.57) AGTR1AGTR2AGTPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434038-A1 Fused imidazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-06-26 EP disclosed