SCHEMBL9854370

SCHEMBL9854370

CCSc1nc2cccnc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.51
AGTR2 P50052 2/20 0.51
LMNA P02545 4/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ATM Q13315 1/20 0.42
THRB P10828 2/20 0.42
TP53 P04637 4/20 0.42
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 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
SCHEMBL9854371 0.93 AGTR1 (0.51) AGTR1AGTR2LMNAHPGDALDH1A1
SCHEMBL8972068 0.86 AGTR1 (0.60) AGTR1AGTR2LMNATP53
SCHEMBL9851478 0.85 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL8560040 0.85 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9402019 0.85 TSHR (0.48) LMNAMAPT
Ammonia Solution, Strong SCHEMBL8563437 0.85 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8972057 0.84 AGTR1 (0.71) AGTR1AGTR2LMNA
SCHEMBL9854484 0.83 AGTR1 (0.49) AGTR1AGTR2LMNAHPGDALDH1A1
SCHEMBL7622112 0.83 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL29486817 0.83 AGTR1 (0.72) AGTR1AGTR2

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-0426021-A1 Condensed imidazole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-05-08 EP disclosed