SCHEMBL934148

SCHEMBL934148

CCC(=O)N(Cc1ccccc1)c1cccc(C#N)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.54
NPC1 O15118 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 4/20 0.52
RAB9A P51151 3/20 0.52
HTT P42858 2/20 0.52
PAX8 Q06710 2/20 0.52
JAK2 O60674 1/20 0.52
LTB4R2 Q9NPC1 2/20 0.49
KCNN4 O15554 1/20 0.49
KCNA5 P22460 1/20 0.49
GLA P06280 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
LMNA P02545 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
MEP1A Q16819 1/20 0.43
MEP1B Q16820 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL934678 0.93 LTB4R2 (0.54) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL934534 0.92 PTGDR2 (0.52) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL934199 0.89 PTGDR2 (0.56) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL934647 0.89 PTGDR2 (0.46) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL2681451 0.89 LTB4R2 (0.44) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL933200 0.89 PTGDR2 (0.56) PTGDR2NPC1MEN1KMT2ALTB4R2
SCHEMBL935192 0.88 PTGDR2 (0.57) PTGDR2NPC1MEN1KMT2ALTB4R2
SCHEMBL933849 0.88 PTGDR2 (0.43) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL933865 0.87 PTGDR2 (0.58) PTGDR2NPC1MEN1KMT2AALDH1A1
SCHEMBL933859 0.86 PTGDR2 (0.58) PTGDR2NPC1ALDH1A1RAB9ALMNA

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 548/4885NPC1 849/4885MEN1 2816/4885

“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.