SCHEMBL935192

SCHEMBL935192

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

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.57
LTB4R2 Q9NPC1 5/20 0.46
OPRM1 P35372 2/20 0.43
KCNH2 Q12809 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
RIPK1 Q13546 1/20 0.43
MEP1A Q16819 1/20 0.43
MEP1B Q16820 1/20 0.43
CYP2C8 P10632 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
TSPO P30536 1/20 0.42
PTPRB P23467 1/20 0.42
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 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
SCHEMBL933200 0.89 PTGDR2 (0.56) PTGDR2LTB4R2MEN1NPC1KMT2A
SCHEMBL934148 0.88 PTGDR2 (0.54) PTGDR2LTB4R2MEP1AMEP1BMEN1
SCHEMBL934199 0.87 PTGDR2 (0.56) PTGDR2LTB4R2MEP1AMEP1BMEN1
SCHEMBL933849 0.86 PTGDR2 (0.43) PTGDR2LTB4R2MEP1AMEP1BMEN1
SCHEMBL934502 0.85 PTGDR2 (0.59) PTGDR2LTB4R2
SCHEMBL934534 0.85 PTGDR2 (0.52) PTGDR2LTB4R2MEP1AMEP1BMEN1
SCHEMBL933859 0.84 PTGDR2 (0.58) PTGDR2TSPONPC1
SCHEMBL934574 0.82 PTGDR2 (0.46) PTGDR2CYP2C8CYP2C9CYP2C19
SCHEMBL934733 0.82 CHRM2 (0.45) PTGDR2LTB4R2MEP1AMEP1BMEN1
SCHEMBL934647 0.82 PTGDR2 (0.46) PTGDR2LTB4R2MEP1AMEP1BMEN1

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 548/4885LTB4R2 51/4885OPRM1 3934/4885

“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.