SCHEMBL5533912

SCHEMBL5533912

Cc1ccc(-c2cc(C(=O)NC(C)(C)C)nn2-c2ccccn2)nc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.51
CNR2 P34972 8/20 0.51
MARS1 P56192 2/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC16A3 O15427 1/20 0.37
SPR P35270 1/20 0.37
RIPK1 Q13546 1/20 0.36
ANO1 Q5XXA6 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK14 Q16539 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36

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
SCHEMBL5524835 0.89 CNR1 (0.50) CNR1CNR2MARS1MEN1KMT2A
SCHEMBL5977928 0.88 CNR1 (0.47) CNR1CNR2RIPK1ANO1
SCHEMBL5524327 0.88 CNR1 (0.38) CNR1CNR2RIPK1ANO1
SCHEMBL5525584 0.88 CNR1 (0.41) CNR1CNR2ANO1
SCHEMBL5522500 0.87 CNR1 (0.48) CNR1CNR2MARS1PKMSLC16A3
SCHEMBL4927931 0.85 MARS1 (0.52) CNR1CNR2MARS1MEN1KMT2A
SCHEMBL5526422 0.83 CNR1 (0.37) CNR1CNR2RIPK1ANO1
SCHEMBL5522031 0.82 CNR1 (0.52) CNR1CNR2MARS1PKMMEN1
SCHEMBL4932988 0.80 ALDH1A1 (0.53) MEN1LMNAKMT2AALDH1A1FFAR4
SCHEMBL5525005 0.79 CNR1 (0.44) CNR1CNR2PKMSLC16A3

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 4 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
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 CNR1 76/4885CNR2 43/4885MARS1 2982/4885

“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.