SCHEMBL9019271

SCHEMBL9019271

CCCCCc1cc(C(=O)O)c(C#N)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.47
HCAR3 P49019 2/20 0.47
GPR84 Q9NQS5 10/20 0.44
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 2/20 0.42
KMT2A Q03164 1/20 0.42
PPARG P37231 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL21060905 0.77 HCAR2 (0.47) HCAR2HCAR3GPR84KMT2A
SCHEMBL9015258 0.76 GPR84 (0.45) GPR84KMT2A
SCHEMBL9019307 0.76 GPR84 (0.45) GPR84KMT2A
SCHEMBL10983500 0.69 CTSV (0.59) HCAR2GPR84KAT8PPARA
SCHEMBL10990305 0.69 KDM5A (0.47) HCAR2HCAR3GPR84KAT8PPARA
SCHEMBL10978966 0.69 CTSV (0.59) HCAR2GPR84KAT8PPARA
SCHEMBL10978475 0.69 CTSV (0.59) HCAR2GPR84KAT8PPARA
SCHEMBL10982575 0.69 KDM5A (0.47) HCAR2HCAR3GPR84KAT8PPARA
SCHEMBL10981682 0.69 KDM5A (0.47) HCAR2HCAR3GPR84KAT8PPARA
SCHEMBL23646003 0.68 HCAR2 (0.54) HCAR2HCAR3GPR84KMT2A

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-0434940-B1 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID CO (US) 1996-05-29 EP claimed