SCHEMBL934306

SCHEMBL934306

CCC(=O)N(Cc1ccc(-c2ccccc2OC)cc1)c1cc(F)cc(C#N)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 10/20 0.47
PTGDR2 Q9Y5Y4 7/20 0.46
NR1H4 Q96RI1 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C8 P10632 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP2C9 P11712 2/20 0.40
SQOR Q9Y6N5 1/20 0.39

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
SCHEMBL933632 0.87 LTB4R2 (0.49) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL2680599 0.87 LTB4R2 (0.48) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL934660 0.86 LTB4R2 (0.48) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL934298 0.84 PTGDR2 (0.59) LTB4R2PTGDR2ALDH1A1LMNAMAPT
SCHEMBL934274 0.81 PTGDR2 (0.57) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL934744 0.81 PTGDR2 (0.44) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL935045 0.80 PTGDR2 (0.48) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL2681116 0.80 PTGDR2 (0.46) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL934229 0.79 PTGDR2 (0.61) PTGDR2CYP2C8CYP2C19CYP2C9
SCHEMBL950982 0.79 PTGDR2 (0.54) LTB4R2PTGDR2CYP2C8CYP2C19CYP2C9

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 LTB4R2 51/4885PTGDR2 548/4885NR1H4 512/4885

“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.