SCHEMBL9032237

SCHEMBL9032237

CCOCCn1ccc2cc(CC(C)=CC(=O)O)ccc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HCAR3 P49019 1/20 0.38
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ NR1H2 P55055 1/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ RORC P51449 1/20 0.37
▸ MCL1 Q07820 2/20 0.36
▸ BCL2 P10415 1/20 0.36
▸ GLO1 Q04760 1/20 0.35
▸ ACACB O00763 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGB1 P05556 1/20 0.35
▸ ITGAV P06756 1/20 0.35
▸ ITGA5 P08648 1/20 0.35
▸ ITGB5 P18084 1/20 0.35

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
SCHEMBL9033787 0.87 RORC (0.39) MTNR1AMTNR1BPPARGNR1H2PPARD
SCHEMBL9034115 0.85 PPARG (0.41) MTNR1AMTNR1BPPARGNR1H2PPARD
SCHEMBL9032977 0.83 OXER1 (0.43) PPARGNR1H2PPARDPPARANR1H3
SCHEMBL9035315 0.83 OXER1 (0.43) PPARGNR1H2PPARDPPARANR1H3
SCHEMBL9032229 0.82 HCAR3 (0.41) HCAR3
SCHEMBL9032245 0.82 HCAR3 (0.41) HCAR3
SCHEMBL9034842 0.80 ACACB (0.39) PPARGNR1H2PPARDPPARANR1H3
SCHEMBL9033295 0.80 CYP2A6 (0.44) —
SCHEMBL9032949 0.79 HTR2C (0.39) PPARGACACB
SCHEMBL9032878 0.79 HDAC8 (0.51) —

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
EP-0511477-B1 Indole derivatives KYOWA HAKKO KOGYO KK (JP) 1996-07-10 — — EP disclosed
US-5239083-A Anticarcinogenic agents, prostate cancer treatment KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-08-24 — — US disclosed
EP-0511477-A1 Indole derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-11-04 — — EP disclosed
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