SCHEMBL11516078

SCHEMBL11516078

[CH]=CC(O)C(C)(C)Oc1cccc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ OGG1 O15527 1/20 0.38
▸ CASR P41180 1/20 0.36
▸ CNR1 P21554 2/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ WDR5 P61964 1/20 0.36
▸ SLC6A4 P31645 2/20 0.35
▸ MAOB P27338 1/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ HSD11B1 P28845 2/20 0.34
▸ HSD11B2 P80365 2/20 0.34
▸ HSP90AB1 P08238 1/20 0.34
▸ PGR P06401 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL11623635 0.82 CETP (0.41) POLBKCNH2LMNA
SCHEMBL11661775 0.81 RELA (0.35) OGG1CASRCNR1CNR2POLB
SCHEMBL11516559 0.80 LMNA (0.36) CASRKMT2AL3MBTL1LMNA
SCHEMBL11517432 0.79 ATM (0.40) POLBMAOBAOC3KDM4EL3MBTL1
SCHEMBL11614514 0.79 OGG1 (0.38) OGG1CASRCNR1CNR2POLB
SCHEMBL11615063 0.76 CNR1 (0.41) OGG1CASRCNR1CNR2POLB
SCHEMBL11664095 0.74 PGR (0.37) OGG1CNR1CNR2POLBWDR5
SCHEMBL8371469 0.73 PGR (0.44) OGG1CNR1CNR2POLBWDR5
SCHEMBL2318592 0.73 WDR5 (0.42) OGG1POLBWDR5SLC6A4HTR2A
SCHEMBL11518530 0.72 POLB (0.37) CNR1CNR2POLBWDR5SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE29926-E 2-Decarboxy-2-hydroxy-methyl-16-fluoro-PGE1 compounds THE UPJOHN COMPANY (US) 1979-03-06 — — US disclosed
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-4055602-A PROSTAGLANDIN THE UPJOHN COMPANY (US) 1977-10-25 — — US disclosed
US-4033989-A 9-Deoxy-PGF2 Analogs THE UPJOHN COMPANY (US) 1977-07-05 — — US disclosed
US-4028419-A PROSTAGLANDINS THE UPJOIN COMPANY (US) 1977-06-07 — — US disclosed
US-4026909-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1977-05-31 — — US disclosed
US-4016184-A PROSTAGLANDINS, BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1977-04-05 — — US disclosed
US-4013695-A PROSTAGLANDINS, HYPOTENSIVES, OXYTOCICS, ANTISECRETORY AND ANTIULCER AGENTS, REPRODUCTION CONTROL THE UPJOHN COMPANY (US) 1977-03-22 — — US disclosed
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