SCHEMBL2303154

SCHEMBL2303154

O=C(O)CC(Cc1nc2cc(Cl)ccc2[nH]1)c1ccc(Cl)c(F)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 9/20 0.69
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
FFAR1 O14842 1/20 0.38
GABBR2 O75899 3/20 0.36
GABBR1 Q9UBS5 3/20 0.36
LMNA P02545 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
NFKB1 P19838 1/20 0.36
DRD3 P35462 1/20 0.36
BLM P54132 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
Hydrochloric Acid SCHEMBL657058 0.99 PRKCZ (0.68) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL2303159 0.92 PRKCZ (0.82) PRKCZRAB9APIN1HSD17B10TDP1
SCHEMBL2303912 0.90 PRKCZ (0.84) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
Hydrochloric Acid SCHEMBL657231 0.89 PRKCZ (0.82) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL659483 0.88 PRKCZ (0.72) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL2302698 0.87 PRKCZ (0.85) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
Hydrochloric Acid SCHEMBL657199 0.87 PRKCZ (0.71) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
Hydrochloric Acid SCHEMBL656242 0.86 PRKCZ (0.84) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL2302057 0.85 PRKCZ (0.69) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL2302061 0.85 PRKCZ (0.69) PRKCZPRKAG1PRKAA2PRKAA1PRKAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP claimed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO claimed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed