SCHEMBL7600436

SCHEMBL7600436

C=CCC(CC=C)(C(=O)O)C(CC)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSPD1 P10809 1/20 0.30
BLM P54132 1/20 0.30
HSPE1 P61604 1/20 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
SCHEMBL27585279 0.81 MMP1 (0.39) ALDH1A1TSHR
SCHEMBL7600439 0.80 GRIK1 (0.33) ALDH1A1TSHR
SCHEMBL1122815 0.77 HSPD1 (0.34) ALDH1A1HSPD1BLMHSPE1
SCHEMBL29139332 0.75 HSPD1 (0.33) HSPD1BLMHSPE1
SCHEMBL29901369 0.75 ALDH1A1 (0.38) ALDH1A1TSHR
SCHEMBL28260440 0.74 CHRM1 (0.32) HSPD1BLMHSPE1
SCHEMBL11676251 0.74 MAPT (0.39) ALDH1A1TSHRHSPD1BLMHSPE1
SCHEMBL11064383 0.72 TSHR (0.36) ALDH1A1TSHRBLM
SCHEMBL27576497 0.72 HSPD1 (0.47) ALDH1A1HSPD1BLMHSPE1
SCHEMBL7784553 0.72 ALDH1A1 (0.33) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2462200-B1 THE USE OF PROTECTIVE BIODEGRADABLE COATINGS FOR PREVENTING THE DEPOSIT OF OVERSPRAY RHODIA OPERATIONS (FR) 2015-11-11 EP claimed
EP-1251122-A1 Process for the preparation of epsilon-Caprolactam DSM N.V. (NL) 2002-10-23 EP disclosed
US-6071846-A OLEFIN POLYMERIZATION CATALYST WHICH ALLOWS A POLYOLEFIN TO HAVE HIGH STEREOREGULARITY AND HIGH POLYMERIZATION ACTIVITY; SOLID TITANIUM CATALYST COMPONENT COMPRISES A MAGNESIUM ATOM, TITANIUM ATOM, HALOGEN ATOM AND ELECTRON DONOR TOKUYAMA CORPORATION (JP) 2000-06-06 US disclosed
EP-0739907-B1 An olefin polymerization catalyst and a polyolefin production method TOKUYAMA CORP (JP) 1999-12-01 EP disclosed
EP-0739907-A1 An olefin polymerization catalyst and a polyolefin production method TOKUYAMA CORPORATION (JP) 1996-10-30 EP disclosed