SCHEMBL9255641

SCHEMBL9255641

C/C=C\OC(O)CCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.37
MAPT P10636 2/20 0.37
TRPA1 O75762 1/20 0.37
DDAH1 O94760 1/20 0.37
GAPDH P04406 1/20 0.37
GPR84 Q9NQS5 7/20 0.36
SPHK1 Q9NYA1 2/20 0.36
FFAR1 O14842 1/20 0.36
LMNA P02545 2/20 0.35
CYP2D6 P10635 2/20 0.34
GMNN O75496 1/20 0.34
POLB P06746 1/20 0.34
THPO P40225 1/20 0.34
MTOR P42345 1/20 0.34
BLM P54132 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CETP P11597 1/20 0.34

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
SCHEMBL9255651 1.00 SMPD1 (0.37) SMPD1MAPTTRPA1DDAH1GAPDH
SCHEMBL4563971 0.94 ALDH1A1 (0.32) SMPD1MAPTTRPA1DDAH1GAPDH
SCHEMBL1475755 0.85
SCHEMBL3693302 0.82 LMNA (0.31) LMNA
SCHEMBL1155677 0.81
SCHEMBL1476470 0.80 SMPD1 (0.41) SMPD1MAPTTRPA1DDAH1GAPDH
SCHEMBL27512546 0.79 MEN1 (0.43) MAPTSPHK1FFAR1LMNACYP2D6
SCHEMBL7205871 0.78 SMPD1 (0.44) SMPD1GPR84SPHK1FFAR1LMNA
SCHEMBL4310007 0.77 FFAR1 (0.45) MAPTFFAR1LMNAGMNNPOLB
SCHEMBL30580550 0.77 TRPA1 (0.47) SMPD1MAPTTRPA1DDAH1GAPDH

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
WO-1995005403-A1 RADIATION CURABLE ALK-1-ENYL ETHER POLYESTER PREPOLYMERS ISP INVESTMENTS INC. (US) 1995-02-23 WO disclosed
US-5373032-A Hardness, flexible, wear and chemical resistant protective coatings ISP INVESTMENTS INC. (US) 1994-12-13 US disclosed
US-5342860-A Unsaturated polyesters based on a alkenyloxy-substituted glycol and having alkenyloxy-substituted alcohol end groups; protective coatings; rapid cure at room temperature ISP INVESTMENTS INC. (US) 1994-08-30 US disclosed