SCHEMBL383485

SCHEMBL383485

Cc1cc(C(=O)C=Cc2ccc(C(=O)O)cc2)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 3/20 0.64
CXCL12 P48061 1/20 0.60
XDH P47989 2/20 0.59
MAPT P10636 4/20 0.58
TERT O14746 1/20 0.58
TP53 P04637 1/20 0.57
CYP3A4 P08684 1/20 0.57
ALOX15 P16050 1/20 0.57
MAPK1 P28482 1/20 0.57
BLM P54132 1/20 0.57
CASP7 P55210 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
STAT3 P40763 1/20 0.55
APP P05067 1/20 0.54
RAB9A P51151 2/20 0.53
POLB P06746 1/20 0.53
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53

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
SCHEMBL383484 1.00 SNCA (0.64) SNCACXCL12XDHMAPTTERT
SCHEMBL10165676 0.89 CYP1B1 (0.64) SNCAXDHMAPTCYP3A4TDP1
SCHEMBL13558899 0.87 ESR1 (0.63) SNCACXCL12XDHMAPTTERT
SCHEMBL385988 0.86 P4HB (0.72) SNCACXCL12MAPTTERTP4HB
SCHEMBL385989 0.86 P4HB (0.72) SNCACXCL12MAPTTERTP4HB
SCHEMBL5692854 0.84 BACE1 (0.56) CXCL12MAPTAPPPOLBPTPN1
SCHEMBL5692848 0.84 BACE1 (0.56) CXCL12MAPTAPPPOLBPTPN1
SCHEMBL11463339 0.82 SNCA (0.88) SNCACXCL12XDHMAPTTERT
SCHEMBL11463338 0.82 SNCA (0.88) SNCACXCL12XDHMAPTTERT
SCHEMBL3334639 0.82 KMT2A (0.67) SNCAMAPTBLMRAB9APOLB

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-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 US disclosed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 US disclosed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US disclosed
EP-1948617-A2 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS Exelixis, Inc. (US) 2008-07-30 EP disclosed
WO-2007048065-A2 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS, INC. (US) 2007-04-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators PIM1, PIM2, PIM3 SNCA 3487/4885CXCL12 2838/4885XDH 1734/4885
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators CSNK2A1, CSNK1A1, CSNK2A2 SNCA 4000/4885CXCL12 2101/4885XDH 697/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.