SCHEMBL3757267

SCHEMBL3757267

COCCCOc1cc(CCC(C)C(C)O)ccc1OC

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.52
REN P00797 11/20 0.45
SIGMAR1 Q99720 3/20 0.43

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
SCHEMBL6947316 0.87 STAT3 (0.52) STAT3REN
SCHEMBL16973663 0.84 SIGMAR1 (0.50) STAT3RENSIGMAR1
SCHEMBL5076405 0.83 STAT3 (0.48) STAT3RENSIGMAR1
SCHEMBL27930278 0.80 STAT3 (0.45) STAT3RENSIGMAR1
SCHEMBL16381568 0.79 SIGMAR1 (0.52) SIGMAR1
SCHEMBL2738334 0.78 ALOX15 (0.55) RENSIGMAR1
SCHEMBL14114916 0.78 ALOX15 (0.55) RENSIGMAR1
SCHEMBL16381566 0.77 ATM (0.47) RENSIGMAR1
SCHEMBL6946630 0.77 REN (0.42) STAT3RENSIGMAR1
SCHEMBL22899046 0.77 ALOX15 (0.55) REN

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
EP-2173696-A1 PREPARATION OF A SATURATED ALDEHYDE DSM IP Assets B.V. (NL) 2010-04-14 EP disclosed
WO-2009007461-A1 PREPARATION OF A SATURATED ALDEHYDE DSM IP ASSETS B.V. (NL) 2009-01-15 WO disclosed