SCHEMBL9296134

SCHEMBL9296134

O=C(O)c1cnc(NCc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)s1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.43
AGTR1 P30556 15/20 0.43
AGTR2 P50052 15/20 0.43
HDAC1 Q13547 2/20 0.36

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
SCHEMBL2878445 0.79 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL4255759 0.78 SCD (0.56) SCDHDAC1
SCHEMBL2876307 0.78 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9295853 0.78 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9591685 0.77 AGTR1 (0.71) AGTR1AGTR2
Hydrochloric Acid SCHEMBL8833923 0.76 ROCK1 (0.39) AGTR1AGTR2
SCHEMBL9296557 0.76 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL8833726 0.75 SMN1; SMN2 (0.38) AGTR1AGTR2
Hydrochloric Acid SCHEMBL9589530 0.75 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9296083 0.74 AGTR1 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5326776-A Tetrazoles ABBOTT LABORATORIES (US) 1994-07-05 US disclosed
WO-1993017681-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-09-16 WO disclosed