SCHEMBL14945882

SCHEMBL14945882

Cc1nc(-c2cccc(-n3nc(CO)c(=O)n(Cc4ccc(Cl)cc4)c3=O)c2)no1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.43
DRD2 P14416 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MET P08581 1/20 0.40
SPHK2 Q9NRA0 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
MAPT P10636 2/20 0.38
HCRTR1 O43613 3/20 0.38
HCRTR2 O43614 3/20 0.38
RHOA P61586 1/20 0.37
AVPR2 P30518 1/20 0.37
AVPR1A P37288 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DAO P14920 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
SCHEMBL3584835 0.88 P2RX3 (0.42) P2RX3DRD2L3MBTL1MAPK1RAB9A
SCHEMBL3577614 0.77 NPC1 (0.46) P2RX3MAPK1RAB9ASMN1; SMN2MAPT
SCHEMBL14945876 0.74 GPBAR1 (0.39) P2RX3AVPR2AVPR1ATSHRHSD17B10
SCHEMBL3584604 0.74 NPC1 (0.48) P2RX3MAPK1RAB9AKMT2ASMN1; SMN2
SCHEMBL14945877 0.72 NPC1 (0.48) P2RX3RAB9AKMT2AMAPTTSHR
SCHEMBL14945881 0.72 L3MBTL1 (0.43) P2RX3L3MBTL1SMN1; SMN2MAPT
SCHEMBL14945870 0.69 NPC1 (0.46) P2RX3MAPK1RAB9AKMT2ASMN1; SMN2
SCHEMBL14945875 0.69 P2RX3 (0.42) P2RX3RAB9AKMT2AMAPT
SCHEMBL3585933 0.68 NPC1 (0.48) P2RX3MAPK1RAB9AKMT2ASMN1; SMN2
SCHEMBL3578648 0.68 NPC1 (0.48) P2RX3MAPK1RAB9AKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140371223-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS ADDEX PHARMA S.A. (CH) 2014-12-18 US disclosed
US-8779129-B2 Triazinedione derivatives as GABAB receptor modulators ADDEX PHARMA S.A. (CH) 2014-07-15 US disclosed
US-20130123262-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS ADDEX PHARMA S.A. (CH) 2013-05-16 US 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-20140371223-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS CHRNA5, GABRA5, GABRB3 P2RX3 224/4885DRD2 110/4885L3MBTL1 3045/4885
US-20130123262-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS CHRNA5, GABRA5, GABRB3 P2RX3 224/4885DRD2 110/4885L3MBTL1 3045/4885

“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.