SCHEMBL7942339

SCHEMBL7942339

CCCCCC(C)(C)c1cc(C)cc(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.52
CNR1 P21554 13/20 0.52
SELL P14151 1/20 0.42
SELP P16109 1/20 0.42
SELE P16581 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CA2 P00918 1/20 0.41
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSPA5 P11021 1/20 0.39

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
SCHEMBL226091 0.91 CNR2 (0.53) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL11781487 0.90 CNR2 (0.55) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL11234325 0.87 CNR2 (0.49) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL11664288 0.86 SMN1; SMN2 (0.52) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL3805396 0.84 HSPA5 (0.60) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL6015499 0.83 CNR1 (0.56) CNR2CNR1
SCHEMBL11483785 0.83 CNR2 (0.46) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL11793178 0.83 HSPA5 (0.46) CNR2CNR1ALDH1A1CA2POLB
SCHEMBL4236467 0.83 HSPA5 (0.58) CNR2CNR1SMN1; SMN2HSPA5
SCHEMBL9321150 0.82 CNR1 (0.58) CNR2CNR1

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-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-4050945-A METALLIC COMPOUND REACTANT, CHELATING COMPOUND REACTANT, BINDER SUZUKI YOSHIO 1977-09-27 US disclosed