SCHEMBL10413446

SCHEMBL10413446

OCC(CO)CCC(CO)(CO)CO

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.31

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
SCHEMBL28118376 0.84 ALDH1A1 (0.36) ALDH1A1LMNA
SCHEMBL1598438 0.76 ALDH1A1 (0.39) ALDH1A1TSHRLMNA
SCHEMBL28067588 0.75 DPP4 (0.41) ALDH1A1TSHRLMNA
SCHEMBL9095207 0.75 ALDH1A1 (0.31) ALDH1A1LMNA
SCHEMBL1904081 0.73 THRB (0.50) ALDH1A1TSHRLMNA
SCHEMBL15183491 0.73 RIPK1 (0.37) ALDH1A1TSHRLMNA
SCHEMBL9186532 0.71 LMNA (0.40) ALDH1A1TSHRLMNA
SCHEMBL10793555 0.71 ALDH1A1 (0.35) ALDH1A1TSHRLMNA
SCHEMBL723922 0.71 LMNA (0.38) ALDH1A1TSHRLMNA
SCHEMBL28099428 0.71 ALDH1A1 (0.39) ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4956265-A POLYUNSATURATED WITH ESTER AND CARBOXY GROUPS; PROTECTIVE COATINGS, GRAPHIC ARTS, PHOTORESTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-09-11 US disclosed
US-4914165-A PHOTOCROSSLINKABLE POLYEPOXIDE POLYESTERS USING POLY (ETHYLENICALLY-UNSATURATED)ALKANOLS AND DICARBOXYLIC ACIDS; PROTECTIVE COATINGS; GRAPHIC ARTS; WEAR RESISTANCE; ADHESION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-04-03 US disclosed
EP-0329298-A2 Radiation crosslinkable compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-08-23 EP disclosed