SCHEMBL14877944

SCHEMBL14877944

CCC(=O)OCC1=CC=CCC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
WRN Q14191 1/20 0.35
HIF1A Q16665 1/20 0.35
NAAA Q02083 1/20 0.34
HTT P42858 1/20 0.33
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL10201649 0.83 ALDH1A1 (0.39) ALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL14304966 0.79 NQO1 (0.38) CYP1A2NPSR1
SCHEMBL13189759 0.79 ALDH1A1 (0.39) ALDH1A1
SCHEMBL18688555 0.79 PTPN1 (0.32)
SCHEMBL21589865 0.79 SMN1; SMN2 (0.36) KDM4E
SCHEMBL18432046 0.79 NPC1 (0.36) ALDH1A1CYP1A2CYP2C19GAAKDM4E
SCHEMBL19825618 0.78 NPC1 (0.37) HTT
SCHEMBL11120396 0.78 TSHR (0.37) ALDH1A1HTT
SCHEMBL23156764 0.76 ELANE (0.38)
SCHEMBL12168631 0.75 GSTP1 (0.31)

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
EP-2799913-B1 OPTICAL MEMBER SET AND SOLID-STATE IMAGE SENSOR USING SAME FUJIFILM CORP (JP) 2017-02-01 EP disclosed
EP-2097387-B1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2016-05-04 EP disclosed
EP-2359862-B1 Hybrid block copolymer micelles with mixed stereochemistry for encapsulation of hydrophobic agents INTEZYNE TECHNOLOGIES INC (US) 2013-07-24 EP disclosed
US-8426477-B1 Polymeric micelles for drug delivery INTEZYNE TECHNOLOGIES, LLC (US) 2013-04-23 US disclosed
US-8426477-B1 Polymeric micelles for drug delivery INTEZYNE TECHNOLOGIES, LLC (US) 2013-04-23 US disclosed