SCHEMBL934124

SCHEMBL934124

CCC(=O)N(Cc1cccc(-c2ccncc2)c1)c1cccc(C#N)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.46
PDK1 Q15118 1/20 0.46
MAPKAPK2 P49137 1/20 0.46
STAT3 P40763 3/20 0.45
MGLL Q99685 1/20 0.44
ABHD6 Q9BV23 2/20 0.43
USP30 Q70CQ3 1/20 0.43
PRMT6 Q96LA8 1/20 0.41
PRKCI P41743 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPRS Q13332 1/20 0.41

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
SCHEMBL934534 0.91 PTGDR2 (0.52) PTGDR2PDK1MAPKAPK2STAT3PTPN2
SCHEMBL934520 0.90 PDK1 (0.51) PTGDR2PDK1PRMT6
SCHEMBL934647 0.89 PTGDR2 (0.46) PTGDR2PDK1HSD17B10
SCHEMBL934632 0.88 PTGDR2 (0.47) PTGDR2PDK1MAPKAPK2STAT3MGLL
SCHEMBL934130 0.84 PTGDR2 (0.43) PTGDR2PDK1STAT3PTPN2PTPN1
SCHEMBL933241 0.84 PDK1 (0.52) PTGDR2PDK1
SCHEMBL934678 0.83 LTB4R2 (0.54) PTGDR2STAT3PTPN2PTPN1PTPRS
SCHEMBL934148 0.83 PTGDR2 (0.54) PTGDR2
SCHEMBL934199 0.82 PTGDR2 (0.56) PTGDR2PDK1HSD17B10
SCHEMBL935192 0.81 PTGDR2 (0.57) PTGDR2

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
EP-2454243-A2 TETRAZOLE DERIVATIVES Merck Serono SA (CH) 2012-05-23 EP disclosed
US-20120115869-A1 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2012-05-10 US disclosed
WO-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 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 (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-20120115869-A1 TETRAZOLE DERIVATIVES TSLP, IL5, CMA1 PTGDR2 548/4885PDK1 1795/4885MAPKAPK2 3342/4885

“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.