SCHEMBL18778587

SCHEMBL18778587

CCC(O)CCCC(O)CC(O)CCCC(O)CC(O)CC(O)CC

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.33
CYP3A4 P08684 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 1/20 0.32
GPR84 Q9NQS5 4/20 0.31
PDCD4 Q53EL6 3/20 0.31
FFAR4 Q5NUL3 1/20 0.30
FFAR1 O14842 1/20 0.30
ALDH1A1 P00352 2/20 0.30
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL18719466 0.90 GPR84 (0.33) USP2CYP3A4SMN1; SMN2GPR84PDCD4
SCHEMBL17340654 0.88 TSHR (0.39) USP2CYP3A4SMN1; SMN2TSHRALDH1A1
SCHEMBL18680057 0.88 TSHR (0.39) USP2CYP3A4SMN1; SMN2TSHR
SCHEMBL18680059 0.88 TSHR (0.39) USP2CYP3A4SMN1; SMN2TSHR
SCHEMBL17231264 0.88 TSHR (0.39) USP2CYP3A4SMN1; SMN2TSHRALDH1A1
SCHEMBL24910330 0.87 ALDH1A1 (0.41) GPR84PDCD4FFAR4FFAR1ALDH1A1
SCHEMBL18853831 0.87 LMNA (0.34) USP2CYP3A4SMN1; SMN2TSHRGPR84
SCHEMBL3829700 0.86 TSHR (0.41) TSHRGPR84FFAR4FFAR1ALDH1A1
SCHEMBL28569252 0.86 TSHR (0.41) TSHRGPR84FFAR4FFAR1ALDH1A1
SCHEMBL29093244 0.86 TSHR (0.41) TSHRGPR84FFAR4FFAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2955198-B1 Ethylene/vinyl acetal-copolymers and their use in lithographic printing plate precursors AGFA GRAPHICS NV (BE) 2017-11-22 EP disclosed
US-20170114158-A1 (ETHYLENE, VINYL ACETAL) COPOLYMERS AND THEIR USE IN LITHOGRAPHIC PRINTING PLATE PRECURSORS AGFA OFFSET BV (BE) 2017-04-27 US disclosed