Sugi Predict

Sugi Predict / Compounds / SCHEMBL9153348

SCHEMBL9153348

SCHEMBL9153348

CCCCc1nn(CC(C)C)c(COCc2ccccc2)c1Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 2/20 0.43
▸ AGTR2 P50052 1/20 0.38

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
SCHEMBL9153924 0.95 AGTR1 (0.40) AGTR1
SCHEMBL9154041 0.94 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9157041 0.93 AGTR1 (0.45) AGTR1
SCHEMBL9151144 0.92 AGTR1 (0.45) AGTR1
SCHEMBL9152249 0.92 AGTR1 (0.45) AGTR1
SCHEMBL9154179 0.91 AGTR1 (0.40) AGTR1
SCHEMBL9150207 0.90 AGTR1 (0.46) AGTR1
SCHEMBL9154298 0.90 AGTR1 (0.44) AGTR1
SCHEMBL9154324 0.88 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9154513 0.88 AGTR1 (0.41) AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5389659-A Hypotensive agents GLAXO GROUP LIMITED (GB) 1995-02-14 — — US disclosed
WO-1993005025-A1 C-LINKED PYRAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1993-03-18 — — WO disclosed
EP-0446062-A1 C-Linked pyrazole derivatives GLAXO GROUP LIMITED (GB) 1991-09-11 — — EP disclosed