SCHEMBL11526413

SCHEMBL11526413

COC(=O)CCCCCC(C(=O)OC)C(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 3/20 0.48
ALDH1A1 P00352 1/20 0.48
PABPC1 P11940 1/20 0.43
APOBEC3A P31941 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
ZDHHC7 Q9NXF8 1/20 0.43
KMT2A Q03164 1/20 0.41
PPARG P37231 2/20 0.40
USP2 O75604 1/20 0.40
DGKA P23743 1/20 0.39
RECQL P46063 1/20 0.39
EPHX2 P34913 1/20 0.38
PPARA Q07869 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL11524968 1.00 TSHR (0.54) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL11526472 1.00 TSHR (0.54) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL11598804 0.98 TSHR (0.56) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL11592937 0.92 TSHR (0.58) TSHRL3MBTL1LMNAALDH1A1ZDHHC7
SCHEMBL11121706 0.89 TSHR (0.50) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL5694365 0.87 ZDHHC7 (0.52) TSHRL3MBTL1LMNAALDH1A1ZDHHC7
SCHEMBL11648130 0.85 ZDHHC7 (0.48) TSHRL3MBTL1LMNAALDH1A1ZDHHC7
SCHEMBL31079537 0.85 LMNA (0.44) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL557135 0.84 ALDH1A1 (0.50) TSHRLMNAALDH1A1KMT2APPARG
SCHEMBL22223431 0.84 TSHR (0.45) TSHRL3MBTL1LMNAALDH1A1PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4161608-A 11 Hydroxy methyl 11-deoxyprostaglandin E1 AYERST, MCKENNA AND HARRISON LIMITED (CA) 1979-07-17 US disclosed
US-4092427-A ANTICOAGULANTS, OXYTOCICS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-05-30 US disclosed
US-4089898-A 11-Deoxyprostaglandin derivatives AYERST, MCKENNA & HARRISON LTD. (CA) 1978-05-16 US disclosed
US-4048329-A HYPERTENSIVE AGENTS, BRONCHODILATOR AGENTS, GASTROINTESTINAL DISORDERS, PROSTAGLANDINS AMERICAN HOME PRODUCTS CORPORATION (US) 1977-09-13 US disclosed
US-4048328-A HYPERTENSIVE AGENTS, BRONCHODILATOR AGENTS, GASTROINTESTINAL DISORDERS, PROSTAGLANDINS AMERICAN HOME PRODUCTS CORPORATION (US) 1977-09-13 US disclosed
US-4036856-A PROSTAGLANDINS AYERST MCKENNA AND HARRISON LTD. (CA) 1977-07-19 US disclosed
US-4007171-A PROSTAGLANDIN AMERICAN HOME PRODUCTS CORPORATION (US) 1977-02-08 US disclosed
US-3987081-A ALKYL DERIVATIVES OF PROSTANOIC ACIDS AND PREPARATION THEREOF AMERICAN HOME PRODUCTS CORPORATION (US) 1976-10-19 US disclosed