SCHEMBL4102377

SCHEMBL4102377

CS(=O)(=O)c1nc2c(ncn2C2CC2)c(=O)n1-c1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.42
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CTSL P07711 1/20 0.38
FLT3 P36888 3/20 0.38
GRM1 Q13255 1/20 0.38
GABRA2 P47869 1/20 0.37
KCNH2 Q12809 1/20 0.37
PDGFRA P16234 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
GRIA4 P48058 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
SCHEMBL4097727 0.81 CNR1 (0.45) CNR1SMN1; SMN2CTSLFLT3GRM1
SCHEMBL4097235 0.81 SMN1; SMN2 (0.48) CNR1CYP1A2CYP3A4SMN1; SMN2TDP1
SCHEMBL1689140 0.76 CNR1 (0.46) CNR1CYP1A2GRM1KCNH2CCNE1
SCHEMBL3175337 0.76 DRD1 (0.39) CNR1CTSLFLT3GRM1KCNH2
SCHEMBL3175346 0.76 DRD1 (0.39) CNR1CTSLFLT3GRM1KCNH2
SCHEMBL4520124 0.75 DRD1 (0.53) CNR1CTSLFLT3GRM1PDGFRA
SCHEMBL4515827 0.75 CNR1 (0.39) CNR1CTSLFLT3GRM1KCNH2
SCHEMBL4521436 0.75 FLT3 (0.39) CNR1CTSLFLT3GRM1KCNH2
SCHEMBL4520425 0.74 CNR1 (0.38) CNR1CTSLFLT3GRM1KCNH2
SCHEMBL5430184 0.74 CNR1 (0.38) CNR1TDP1CTSLFLT3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233947-A1 2,3-Substituted fused bicyclic pyrimidin-4(3H)-ones which modulating the function of the vanilloid -1 receptor (VR1) MERCK SHARP & DOHME LTD. (GB) 2009-09-17 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 (1 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-20090233947-A1 2,3-Substituted fused bicyclic pyrimidin-4(3H)-ones which modulating the function of the vanilloid -1 receptor (VR1) TRPV1, TRPV2, TRPV3 CNR1 30/4885CYP1A2 1067/4885CYP3A4 869/4885

“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.