SCHEMBL6377017

SCHEMBL6377017

C#C[C@H](Cc1cccc(COC)c1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 1/20 0.33
SLC16A1 P53985 1/20 0.33
MCTS1 Q9ULC4 1/20 0.33
PSMB5 P28074 1/20 0.32
PTGER4 P35408 3/20 0.32
PTGER2 P43116 1/20 0.31
IDO1 P14902 2/20 0.31
AGXT P21549 2/20 0.31
FFAR1 O14842 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
HDAC5 Q9UQL6 1/20 0.30
TAAR1 Q96RJ0 2/20 0.30

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
SCHEMBL7655260 1.00 SLC16A3 (0.33) SLC16A3SLC16A1MCTS1PSMB5PTGER4
SCHEMBL6137571 0.82 MAOB (0.40) TAAR1
SCHEMBL6137564 0.82 MAOB (0.40) TAAR1
SCHEMBL9794039 0.81 HTR2A (0.49) IDO1TAAR1
SCHEMBL9794051 0.81 HTR2A (0.49) IDO1TAAR1
SCHEMBL6375850 0.75 PTGER4 (0.34) PSMB5PTGER4PTGER2
SCHEMBL6381407 0.72 FFAR1 (0.38) PTGER4FFAR1TAAR1
SCHEMBL17256202 0.72 OPRM1 (0.30) PTGER4
SCHEMBL6380217 0.72 PTGER4 (0.35) PTGER4PTGER2
SCHEMBL9793858 0.71 BLM (0.35)

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
EP-1097922-B1 5-THIA-OMEGA-SUBSTITUTED PHENYL-PROSTAGLANDIN E DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2005-03-16 EP disclosed
US-6586468-B1 Prostaglandin derivatives having preferential binding to prostaglandin E2 receptors used for prophylaxis of autoimmune and graft versus host diseases, respiratory system, liver and sleep disorders; side effect reduction ONO PHARMACEUTICAL CO., LTD. (JP) 2003-07-01 US disclosed
US-6462081-B1 SUCH AS A 9-OXO-11,15-DIHYDROXY-16-(3-METHOXYMETHYLPHENYL)-17,18,19,20-TETRANOR-5 -THIAPROST-13-ENOIC ACID; PROSTAGLANDIN E2 RECEPTOR BINDERS; AMYOTROPHIC LATERAL SCLEROSIS, LUPUS, MULTIPLE SCLEROSIS, SJOEGREN'S SYNDROME, RHEUMARTHROSIS ONO PHARMACEUTICAL CO., LTD. (JP) 2002-10-08 US disclosed
EP-1114816-A1 $g(v)-SUBSTITUTED PHENYL-PROSTAGLANDIN E DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-07-11 EP disclosed
EP-1097922-A1 5-THIA-OMEGA-SUBSTITUTED PHENYL-PROSTAGLANDIN E DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-05-09 EP disclosed
US-6043275-A BIND PROSTAGLANDIN E2 RECEPTOR; PREVENTION AND/OR TREATMENT OF IMMUNOLOGICAL DISEASES, ASTHMA, ABNORMAL BONE FORMATION, NEURONAL CELL DEATH, LIVER DAMAGE, NEPHRITIS, HYPERTENSION, MYOCARDIAC ISCHEMIA, SLEEPING DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 2000-03-28 US disclosed
EP-0985663-A1 A 3.7-dithiaprostanoic acid derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed