SCHEMBL7834869

SCHEMBL7834869

CCCCc1cc(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccccc2n1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.59
AGTR1 P30556 3/20 0.57
AGTR2 P50052 3/20 0.57
BRS3 P32247 2/20 0.54
PPARG P37231 1/20 0.53

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
SCHEMBL8501790 0.90 PLA2G2A (0.52) DHODHAGTR1AGTR2
SCHEMBL7834873 0.85 DHODH (0.47) DHODHAGTR1AGTR2
SCHEMBL9119796 0.85 DHODH (0.53) DHODHAGTR1AGTR2
SCHEMBL9709750 0.84 DHODH (0.59) DHODHAGTR1AGTR2BRS3PPARG
SCHEMBL8505737 0.83 DHODH (0.55) DHODHAGTR1AGTR2BRS3PPARG
SCHEMBL8504852 0.82 AGTR1 (0.56) DHODHAGTR1AGTR2PPARG
SCHEMBL8504620 0.80 BRS3 (0.54) DHODHAGTR1AGTR2BRS3
SCHEMBL9654571 0.79 AGTR1 (0.56) DHODHAGTR1AGTR2
SCHEMBL9709741 0.79 KDM4E (0.57) DHODHAGTR1AGTR2BRS3PPARG
SCHEMBL3906504 0.78 BRS3 (0.70) DHODHAGTR1AGTR2BRS3

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-0498723-B1 Nitrogen containing bicycle compounds, method for their preparation, their use as pharmaceutical and compositions containing them AVENTIS PHARMA SA (FR) 2001-09-19 EP claimed
US-6004979-A ANGIOTENSIN II INHIBITORS; 4-((CARBOXY)ARYLOXY)-QUINOLINE DERIVATIVES HOECHST MARION ROUSSEL (FR) 1999-12-21 US disclosed