SCHEMBL5526892

SCHEMBL5526892

CCN(C)C(=O)c1cc(-c2ccc(C)nc2)n(-c2ccc(OC)nn2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
ALOX5 P09917 2/20 0.36
MALT1 Q9UDY8 1/20 0.36
NPC1 O15118 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GABRA1 P14867 5/20 0.34
CHRNA7 P36544 2/20 0.34
BCL2 P10415 1/20 0.34
MDM2 Q00987 1/20 0.34
MCL1 Q07820 1/20 0.34
PDE10A Q9Y233 1/20 0.34
OXTR P30559 1/20 0.33
RPA1 P27694 1/20 0.33

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
SCHEMBL5529139 0.87 MALT1 (0.42) MALT1CHRNA7BCL2MDM2MCL1
SCHEMBL5268373 0.86 RPA1 (0.45) ALDH1A1TSHRKDM5AKDM4CKDM5B
SCHEMBL5270243 0.85 SMN1; SMN2 (0.40) ALDH1A1TSHRALOX5MALT1NPC1
SCHEMBL5525755 0.82 ALDH1A1 (0.37) ALDH1A1TSHRALOX5NPC1RECQL
SCHEMBL5527560 0.80 ALDH1A1 (0.35) ALDH1A1TSHRALOX5NPC1RECQL
SCHEMBL5528164 0.78 ALDH1A1 (0.39) ALDH1A1TSHRALOX5NPC1RECQL
SCHEMBL5520987 0.78 CYP11B1 (0.34) ALDH1A1TSHRALOX5NPC1RECQL
SCHEMBL5525761 0.78 OXTR (0.42) ALDH1A1TSHRKDM5AKDM4CKDM5B
SCHEMBL5532092 0.77 MALT1 (0.41) MALT1CHRNA7BCL2MDM2MCL1
SCHEMBL5269005 0.77 GABRA1 (0.51) ALOX5MALT1GABRA1CHRNA7

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 ALDH1A1 171/4885TSHR 3156/4885ALOX5 36/4885

“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.