SCHEMBL5519940

SCHEMBL5519940

CCN(C)C(=O)c1cc(-c2ccc(C#N)cn2)n(-c2ccc(C)nc2)n1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 2/20 0.38
KDM1A O60341 13/20 0.36
MALT1 Q9UDY8 1/20 0.35
OXTR P30559 1/20 0.34
AVPR1A P37288 1/20 0.34
USP14 P54578 1/20 0.34

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
SCHEMBL14420766 0.90 KDM1A (0.35) RPA1KDM1AMALT1
SCHEMBL5521163 0.88 OXTR (0.45) RPA1KDM1AMALT1OXTRAVPR1A
SCHEMBL5520085 0.87 MALT1 (0.37) RPA1MALT1
SCHEMBL5523503 0.86 KDM1A (0.36) RPA1KDM1AMALT1OXTR
SCHEMBL5267891 0.85 RPA1 (0.50) RPA1KDM1A
SCHEMBL5522089 0.85 MALT1 (0.35) RPA1MALT1
SCHEMBL5270003 0.84 CA9 (0.43) RPA1
SCHEMBL5530270 0.82 MALT1 (0.34) RPA1MALT1
SCHEMBL5524209 0.82 PIK3CA (0.35) RPA1MALT1
SCHEMBL5517569 0.82 MDM2 (0.38) RPA1MALT1

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
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 EP 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-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 RPA1 1661/4885KDM1A 489/4885MALT1 3117/4885

“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.