SCHEMBL9787876

SCHEMBL9787876

CCCCCCCCCCCCC1=NC(C)(CO)CO1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 4/20 0.34
LPL P06858 4/20 0.33
LIPG Q9Y5X9 4/20 0.33
SIRT2 Q8IXJ6 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL10491845 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL676589 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL10618565 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL9787920 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL10491918 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL676681 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL10619653 1.00 PRKCA (0.34) PRKCALPLLIPGSIRT2GAA
SCHEMBL5986963 0.91 EPHX2 (0.38) PRKCA
SCHEMBL5986968 0.91 EPHX2 (0.38) PRKCA
SCHEMBL677125 0.91 EPHX2 (0.38) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4876249-A TOPICAL; TRANSDERMAL, SYSTEMIC; FLUOCINOLINE ACETONIDE AND IMIDAZOLINE OR OXAZOLINE PENETRATION ENHANCER MIXTURE; THERAPEUTIC DRUGS THERAPEUTIC PATCH RESEARCH N.V. 1989-10-24 US claimed
EP-0296199-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA, Vithal J. (US) 1988-12-28 EP claimed
WO-1988004938-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA VITHAL J (US) 1988-07-14 WO claimed
US-5030629-A Transdermal Administration Of Cardiovascular Agents THERAPEUTIC PATCH RESEARCH N.V. 1991-07-09 US disclosed
US-4876249-A TOPICAL; TRANSDERMAL, SYSTEMIC; FLUOCINOLINE ACETONIDE AND IMIDAZOLINE OR OXAZOLINE PENETRATION ENHANCER MIXTURE; THERAPEUTIC DRUGS THERAPEUTIC PATCH RESEARCH N.V. 1989-10-24 US disclosed
EP-0296199-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA, Vithal J. (US) 1988-12-28 EP disclosed
WO-1988004938-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA VITHAL J (US) 1988-07-14 WO disclosed