SCHEMBL11612975

SCHEMBL11612975

[CH2]CC(O)C(C)(C)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ CETP P11597 5/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAOB P27338 1/20 0.40
▸ AOC3 Q16853 1/20 0.40
▸ PNMT P11086 1/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.39

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
SCHEMBL11663978 0.83 L3MBTL1 (0.41) PPARGPPARAKDM4EALDH1A1GAA
SCHEMBL11615063 0.79 CNR1 (0.41) KDM4EMAOBAOC3
SCHEMBL11611192 0.78 LMNA (0.40) PPARGPPARAL3MBTL1
SCHEMBL11517432 0.77 ATM (0.40) PPARGPPARACETPKDM4EALDH1A1
SCHEMBL11610243 0.76 PPARG (0.40) PPARGPPARACETPKDM4EALDH1A1
SCHEMBL11663126 0.75 KDM4E (0.42) PPARGPPARAKDM4EALDH1A1GAA
SCHEMBL2737127 0.74 L3MBTL1 (0.47) PPARGPPARAKDM4EL3MBTL1MAOB
SCHEMBL11613592 0.74 KDM4E (0.49) PPARGPPARAKDM4EALDH1A1GAA
SCHEMBL8709433 0.73 L3MBTL1 (0.50) KDM4EALDH1A1L3MBTL1MAOBAOC3
SCHEMBL11614193 0.72 HTR2A (0.49) CETPMAOB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4122282-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-10-24 — — US disclosed
US-4099014-A BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1978-07-04 — — US disclosed
US-4085139-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-04-18 — — US disclosed
US-4081478-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-03-28 — — US disclosed
US-4073808-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-02-14 — — US disclosed
US-4033989-A 9-Deoxy-PGF2 Analogs THE UPJOHN COMPANY (US) 1977-07-05 — — US disclosed
US-4016184-A PROSTAGLANDINS, BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1977-04-05 — — US disclosed
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