Sugi Predict

Sugi Predict / Compounds / SCHEMBL9509637

SCHEMBL9509637

SCHEMBL9509637

CCCCc1nc2c(Cc3ccc(-c4ccccc4)c(C(=O)O)c3)c(CO)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BRS3 P32247 7/20 0.47
▸ DHODH Q02127 1/20 0.42
▸ FOLH1 Q04609 1/20 0.40
▸ AGTR1 P30556 1/20 0.39
▸ AGTR2 P50052 1/20 0.39

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
SCHEMBL9510826 0.90 BRS3 (0.55) BRS3AGTR1AGTR2
SCHEMBL9452730 0.86 BRS3 (0.57) BRS3AGTR1AGTR2
SCHEMBL8741191 0.84 BRS3 (0.47) BRS3DHODHFOLH1AGTR1AGTR2
SCHEMBL9304542 0.76 BRS3 (0.56) BRS3AGTR1AGTR2
SCHEMBL9452733 0.75 BRS3 (0.56) BRS3AGTR1AGTR2
SCHEMBL9202144 0.74 AGTR1 (0.46) BRS3DHODHFOLH1AGTR1AGTR2
SCHEMBL3737185 0.73 FOLH1 (0.63) BRS3DHODHFOLH1AGTR1AGTR2
SCHEMBL9529409 0.73 BRS3 (0.55) BRS3AGTR1AGTR2
SCHEMBL8504803 0.71 DHODH (0.51) BRS3DHODHFOLH1AGTR1AGTR2
SCHEMBL9200610 0.70 BRS3 (0.42) BRS3AGTR1AGTR2

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
EP-0561979-A1 USE OF ANGIOTENSIN II ANTAGONISTS IN THE TREATMENT OF ANGINA PECTORIS SMITHKLINE BEECHAM PLC (GB) 1993-09-29 — — EP disclosed
EP-0561905-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF MACULAR DEGENERATION SMITHKLINE BEECHAM PLC (GB) 1993-09-29 — — EP disclosed