SCHEMBL4284415

SCHEMBL4284415

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)(OO)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.69
CYP46A1 Q9Y6A2 2/20 0.69
LMNA P02545 1/20 0.69
ABCB1 P08183 1/20 0.69
OSBP P22059 1/20 0.69
RORC P51449 1/20 0.69
OSBP2 Q969R2 1/20 0.69
GRIN1 Q05586 12/20 0.64
GRIN2B Q13224 12/20 0.64
GRIN2A Q12879 10/20 0.62
POLA1 P09884 1/20 0.62
SRD5A1 P18405 2/20 0.59

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
SCHEMBL7741660 0.94 USP2 (0.70) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL1243707 0.90 USP2 (0.66) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL10929495 0.89 USP2 (0.65) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL10930823 0.89 USP2 (0.65) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL10929500 0.89 USP2 (0.65) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL8605712 0.89 CYP46A1 (0.64) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL3977940 0.89 CYP46A1 (0.64) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL3508152 0.89 CYP46A1 (0.71) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL103515 0.89 USP2 (0.74) USP2CYP46A1LMNAABCB1OSBP
SCHEMBL4961477 0.89 GRIN1 (0.80) USP2CYP46A1LMNAABCB1OSBP

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3125941-A1 METHOD FOR THE DIAGNOSTIC DETERMINATION OF THE RISK CAUSED BY AN ALTERED OXIDATIVE BALANCE H&D S.r.l. (IT) 2017-02-08 EP disclosed
WO-2015151023-A1 METHOD FOR THE DIAGNOSTIC DETERMINATION OF THE RISK CAUSED BY AN ALTERED OXIDATIVE BALANCE H&D S.R.L. (IT) 2015-10-08 WO disclosed
US-20140205617-A1 Compositions and Methods for Treatment of Neoplastic Disease TERMAN DAVID S (US) 2014-07-24 US disclosed
US-8524218-B2 Compositions and methods for treatment of neoplastic disease TERMAN DAVID S (US) 2013-09-03 US disclosed
US-20090123444-A1 delivering a therapeutic agent to a solid tumor characterized by hypoxia, acidosis and hypertonicity comprising loading the therapeutic agent into sickle red blood cells; tissue targeted therapy; drug delivery TERMAN DAVID 2009-05-14 US disclosed
US-20050112141-A1 Compositions and methods for treatment of neoplastic disease GRANDVIEW, LLC 2005-05-26 US disclosed