SCHEMBL2741247

SCHEMBL2741247

Cc1c(C)c(C(C)(C)C)c(O)c(C)c1O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CA2 P00918 1/20 0.33
POLB P06746 1/20 0.33
TYR P14679 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL2741240 0.92 CA2 (0.35) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL15504703 0.89 ALDH1A1 (0.33) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL784967 0.88 CA2 (0.36) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL784952 0.85 CA2 (0.38) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL7907472 0.82 CA2 (0.36) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL11529852 0.81 ALDH1A1 (0.32) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL20558662 0.80 CA2 (0.35) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL298177 0.77 ALOX5 (0.32) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL8106600 0.77 CA2 (0.36) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL11656526 0.76 ALDH1A1 (0.32) ALDH1A1CA2POLBTYRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9523060-B2 Lubricant oil compositions POLNOX CORPORATION (US) 2016-12-20 US disclosed
US-20150159109-A1 Lubricant Oil Compositions POLNOX CORPORATION 2015-06-11 US disclosed
US-8927472-B2 Lubricant oil compositions POLNOX CORPORATION (US) 2015-01-06 US disclosed
US-20130130955-A1 LUBRICANT OIL COMPOSITIONS POLNOX CORPORATION (US) 2013-05-23 US disclosed
US-20120004150-A1 Lubricant Oil Compositions POLNOX CORPORATION 2012-01-05 US disclosed