SCHEMBL4903380

SCHEMBL4903380

C=C(C)C(=O)OC1(c2ccc(Cl)cc2)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.41
HDAC4 P56524 1/20 0.41
SLC6A4 P31645 7/20 0.39
SLC6A3 Q01959 7/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
SLC6A2 P23975 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CCR2 P41597 1/20 0.37

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
SCHEMBL10062521 0.87 CA1 (0.38) DRD2DRD4DRD3LMNAMAPT
SCHEMBL25564667 0.85 HSD11B1 (0.43) HSD11B1SLC6A4SLC6A3DRD2DRD4
SCHEMBL25960357 0.85 OPRM1 (0.34) LMNA
SCHEMBL17914408 0.85 HRH3 (0.35) LMNA
SCHEMBL10062522 0.85 CA1 (0.38) HSD11B1SLC6A3DRD2DRD4DRD3
SCHEMBL1130178 0.85 AKR1C1 (0.42) HDAC4
SCHEMBL25698983 0.85 ESR2 (0.42) LMNAMAPTALDH1A1MAPK1
SCHEMBL25564653 0.84 HSD11B1 (0.41) HSD11B1SLC6A4SLC6A3DRD2DRD4
SCHEMBL25960355 0.84 OPRM1 (0.35) LMNA
SCHEMBL13347349 0.83 AKR1C1 (0.43) HDAC4DRD3ALDH1A1

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-20080003288-A1 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2008-01-03 US disclosed
US-7204997-B2 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2007-04-17 US disclosed
EP-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
US-20030152623-A1 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2003-08-14 US disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed