SCHEMBL17475475

SCHEMBL17475475

O=C1CCCCC(OC(=O)OCC(O)CO)O1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.30
PRKCA P17252 3/20 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
SCHEMBL5078471 0.82 CYP2D6 (0.32) CYP2D6
SCHEMBL66277 0.79 NAAA (0.32) CYP2D6
SCHEMBL3661912 0.77
SCHEMBL6869580 0.77
SCHEMBL6871660 0.76 PRKCA (0.30) PRKCA
SCHEMBL6932463 0.75 CHRM2 (0.30)
SCHEMBL18170328 0.73 NAAA (0.36)
SCHEMBL8967007 0.71 ATM (0.30)
SCHEMBL10963251 0.70 TSHR (0.36) CYP2D6
SCHEMBL6851006 0.70 CA1 (0.35) PRKCA

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-20160033383-A1 PORTABLE SENSORS FOR DETERMINATION OF LIQUID SURFACE TENSION, AND METHODS OF USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-04 US disclosed