SCHEMBL10982575

SCHEMBL10982575

CCCCCCCCCc1cc2cccc(C(=O)O)c2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
DHODH Q02127 1/20 0.47
GPR84 Q9NQS5 9/20 0.46
KAT8 Q9H7Z6 2/20 0.45
HCAR2 Q8TDS4 2/20 0.45
PPARA Q07869 1/20 0.45
PARP1 P09874 1/20 0.44
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
HCAR3 P49019 1/20 0.43
PLK1 P53350 1/20 0.42

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
SCHEMBL10990305 1.00 KDM5A (0.47) KDM5AKDM5BDHODHGPR84KAT8
SCHEMBL10981682 1.00 KDM5A (0.47) KDM5AKDM5BDHODHGPR84KAT8
SCHEMBL27285942 0.94 KDM5A (0.49) KDM5AKDM5BDHODHHCAR2PARP1
SCHEMBL7416444 0.86 MTNR1A (0.46) GPR84PARP1CTSVCTSL
SCHEMBL13492005 0.83 DHODH (0.54) KDM5AKDM5BDHODHPARP1
SCHEMBL27628586 0.81 CTSV (0.50) GPR84KAT8HCAR2PPARAPARP1
SCHEMBL7412802 0.80 MTNR1A (0.48) PARP1
SCHEMBL10978966 0.78 CTSV (0.59) GPR84KAT8HCAR2PPARAPARP1
SCHEMBL10978475 0.78 CTSV (0.59) GPR84KAT8HCAR2PPARAPARP1
SCHEMBL10983500 0.78 CTSV (0.59) GPR84KAT8HCAR2PPARAPARP1

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-4493843-A Indole and indoline carboxylic acid compounds and method of use MAY & BAKER LIMITED (GB) 1985-01-15 US disclosed
EP-0042298-B1 INDOLE AND INDOLINE DERIVATIVES MAY & BAKER LIMITED (GB) 1984-09-12 EP disclosed
EP-0042298-A1 Indole and indoline derivatives MAY & BAKER LIMITED (GB) 1981-12-23 EP disclosed