SCHEMBL270212

SCHEMBL270212

CCCCCCCCC(CCCC)(CCCC)OP(=O)(O)O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.67
GGPS1 O95749 7/20 0.53
FDPS P14324 10/20 0.52
LPAR3 Q9UBY5 4/20 0.50
LPAR1 Q92633 3/20 0.50
LPAR2 Q9HBW0 2/20 0.48

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
SCHEMBL31050141 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL9657887 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL27997838 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL25176945 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL9659793 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL25176436 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL8040338 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL269197 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL28348564 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL25174113 0.98 SMPD1 (0.69) SMPD1GGPS1FDPSLPAR3LPAR1

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-8133835-B2 Molecular weight controllable, high 1,4-trans polybutadiene catalyst system KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2012-03-13 US claimed
US-8133835-B2 Molecular weight controllable, high 1,4-trans polybutadiene catalyst system KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2012-03-13 US disclosed
US-20100261847-A1 MOLECULAR WEIGHT CONTROLLABLE, HIGH 1,4-TRANS POLYBUTADIENE CATALYST SYSTEM KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2010-10-14 US disclosed