SCHEMBL11636364

SCHEMBL11636364

CCCCCCCCCCCC(C)(C)OP(O)O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.38
SMPD1 P17405 5/20 0.37
FDPS P14324 9/20 0.36
CES2 O00748 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR3 Q9UBY5 1/20 0.35

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
SCHEMBL9156566 1.00 GGPS1 (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL8926607 1.00 GGPS1 (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL11065631 0.82 TSHR (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL9156559 0.82 TSHR (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL11636360 0.82 TSHR (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL1921065 0.81 LMNA (0.31)
SCHEMBL10390922 0.80 GGPS1 (0.39) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL11611962 0.78 GGPS1 (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL271122 0.78 GGPS1 (0.38) GGPS1SMPD1FDPSCES2LPAR1
SCHEMBL270050 0.78 GGPS1 (0.38) GGPS1SMPD1FDPSCES2LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227322-A Stabilizer composition, vinyl chloride resin composition containing same, and molded article thereof 株式会社ADEKA 2021-08-06 CN disclosed
US-4096192-A DIOL REACTED WITH ACROLEIN, HYDROFORMYLATION, HYDROGENATION, HYDROLYSIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-06-20 US disclosed
US-4024197-A 2-VINYL-5-METHYL-1,3-DIOXANE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-05-17 US disclosed
US-3998622-A FROM RHODIUM TRIALKYL PHOSPHITE LIGAND COMPLEX CATALYST; HOLLOW, POROUS AGGLOMERATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-12-21 US disclosed
US-3963755-A Mixture of 2(2'-propanal)-5-methyl-1,3-dioxane and 2(3'-propanal)-5-methyl-1,3-dioxane E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-15 US disclosed
US-3963754-A 2-Vinyl-5-methyl-1,3-dioxane E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-15 US disclosed