Sugi Predict

Sugi Predict / Compounds / SCHEMBL9843834

SCHEMBL9843834

SCHEMBL9843834

CCCCc1nc(C)cc(=O)n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 3/20 0.69
▸ AGTR2 P50052 3/20 0.69

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
SCHEMBL9844182 0.89 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9704873 0.83 AGTR1 (0.74) AGTR1AGTR2
SCHEMBL9704741 0.83 AGTR1 (0.74) AGTR1AGTR2
SCHEMBL9129219 0.83 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL5865290 0.83 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9844226 0.83 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8396598 0.82 AGTR1 (0.79) AGTR1AGTR2
SCHEMBL4305127 0.82 PPARG (0.58) AGTR1AGTR2
SCHEMBL9336732 0.82 AGTR1 (0.75) AGTR1AGTR2
SCHEMBL9039836 0.82 AGTR1 (0.51) 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-0407342-A2 Pyrimidine derivatives CIBA-GEIGY AG (CH) 1991-01-09 — — EP disclosed