SCHEMBL11234601

SCHEMBL11234601

CCCCCCCCCC(OP(=O)(OC(CCCCCCCCC)c1ccccc1)OC(CCCCCCCCC)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.41
CETP P11597 3/20 0.41
ALDH1A1 P00352 1/20 0.40
NAAA Q02083 2/20 0.40

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
SCHEMBL10975518 1.00 SMPD1 (0.41) SMPD1CETPALDH1A1NAAA
SCHEMBL10533186 1.00 SMPD1 (0.41) SMPD1CETPALDH1A1NAAA
SCHEMBL4943604 0.98 SLC7A5 (0.40) SMPD1CETP
SCHEMBL27353954 0.88 SMPD1 (0.54) SMPD1CETPALDH1A1NAAA
SCHEMBL11796536 0.88 SMPD1 (0.54) SMPD1CETPALDH1A1NAAA
SCHEMBL10975523 0.88 SMPD1 (0.54) SMPD1CETPALDH1A1NAAA
SCHEMBL11234605 0.88 SMPD1 (0.54) SMPD1CETPALDH1A1NAAA
SCHEMBL11140385 0.86 POLB (0.42)
SCHEMBL28982744 0.86 SMPD1 (0.53) SMPD1CETPALDH1A1NAAA
SCHEMBL28982716 0.86 SMPD1 (0.53) SMPD1CETPALDH1A1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4312907-A FOR TENTS; HYDROPHILIC, WATER-INSOLUBLE PARTICLES OF DROP-PREVENTING AGENT HIRAOKA & CO. LTD. (JP) 1982-01-26 US disclosed