SCHEMBL933859

SCHEMBL933859

CCC(=O)N(Cc1cccc(OC)c1)c1cccc(C#N)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.58
MCHR1 Q99705 1/20 0.47
RAB9A P51151 2/20 0.46
PTGES O14684 2/20 0.44
TSPO P30536 1/20 0.44
ALOX5 P09917 1/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CHRM2 P08172 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
P4HB P07237 1/20 0.43
CLK1 P49759 1/20 0.43
MAPT P10636 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL933865 0.90 PTGDR2 (0.58) PTGDR2RAB9ATSPOKDM4EALDH1A1
SCHEMBL935176 0.89 PTGDR2 (0.61) PTGDR2BCHEACHE
SCHEMBL934574 0.87 PTGDR2 (0.46) PTGDR2
SCHEMBL934229 0.87 PTGDR2 (0.61) PTGDR2MCHR1RAB9APTGESTSPO
SCHEMBL934148 0.86 PTGDR2 (0.54) PTGDR2RAB9AALDH1A1LMNAHPGD
SCHEMBL934199 0.85 PTGDR2 (0.56) PTGDR2RAB9AKDM4EALDH1A1LMNA
SCHEMBL935192 0.84 PTGDR2 (0.57) PTGDR2TSPONPC1
SCHEMBL933849 0.84 PTGDR2 (0.43) PTGDR2RAB9AALDH1A1HPGDCHRM2
SCHEMBL934534 0.83 PTGDR2 (0.52) PTGDR2RAB9APTGESALDH1A1NPC1
SCHEMBL934502 0.81 PTGDR2 (0.59) PTGDR2PTGES

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 548/4885MCHR1 3242/4885RAB9A 2889/4885

“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.