Sugi Predict

Sugi Predict / Compounds / SCHEMBL6087780

SCHEMBL6087780

SCHEMBL6087780

CCCC1OC1CCCCCCCCCC1OC1CC

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.34
▸ SPHK1 Q9NYA1 4/20 0.33
▸ SPHK2 Q9NRA0 3/20 0.33
▸ EPHX1 P07099 1/20 0.32

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
SCHEMBL14923203 1.00 ALDH1A1 (0.34) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL17900418 0.92 ALDH1A1 (0.39) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL18597295 0.92 ALDH1A1 (0.39) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL50931 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL50942 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL9129567 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL14900105 0.90 ALDH1A1 (0.39) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL8855729 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL51130 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1
SCHEMBL11436974 0.90 ALDH1A1 (0.44) ALDH1A1SPHK1SPHK2EPHX1

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
US-7074947-B2 Process for producing epoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-11 — — US disclosed
US-20050020841-A1 Process for producing expoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-27 — — US disclosed