SCHEMBL11007109

SCHEMBL11007109

CCCCCCc1ccc2[nH]c(=O)cc(O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 9/20 0.51
▸ KAT8 Q9H7Z6 2/20 0.49
▸ PPARA Q07869 1/20 0.49
▸ CTSV O60911 1/20 0.47
▸ CTSL P07711 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ HTR1D P28221 1/20 0.47
▸ HTR1B P28222 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ UNG P13051 3/20 0.46

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
SCHEMBL23695580 0.94 GPR84 (0.52) GPR84KAT8PPARACTSVCTSL
SCHEMBL7069908 0.86 LMNA (0.50) GPR84CTSVCTSLHTR1AHTR1D
SCHEMBL7074282 0.84 LMNA (0.51) GPR84CTSVCTSLHTR1AHTR1D
SCHEMBL2056333 0.82 KDM4E (0.54) GPR84KDM4EALDH1A1
SCHEMBL2267028 0.81 KDM4E (0.53) KDM4EALDH1A1
SCHEMBL12100781 0.80 HTR1A (0.57) KAT8PPARACTSVCTSLHTR1A
SCHEMBL4581413 0.80 HTR1A (0.57) KAT8PPARACTSVCTSLHTR1A
SCHEMBL12795553 0.80 HTR1A (0.57) KAT8PPARACTSVCTSLHTR1A
SCHEMBL1128166 0.80 HTR1A (0.57) KAT8PPARACTSVCTSLHTR1A
SCHEMBL31410497 0.80 HTR1A (0.57) KAT8PPARACTSVCTSLHTR1A

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
US-4526894-A Antiinflammatory agents NIPPON SHINYAKU CO. LTD. (JP) 1985-07-02 — — US disclosed
EP-0101330-A2 2-Quinolone derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1984-02-22 — — EP disclosed
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