SCHEMBL5524832

SCHEMBL5524832

CC(C)(CF)NC(=O)c1cc(-c2ccc(Cl)cn2)n(-c2cccnc2)n1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.54
CNR2 P34972 8/20 0.54
MARS1 P56192 3/20 0.47
MALT1 Q9UDY8 4/20 0.40
DHODH Q02127 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NTRK1 P04629 3/20 0.39
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38

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
SCHEMBL5978720 0.92 CNR2 (0.65) CNR1CNR2MARS1MALT1MEN1
SCHEMBL5522045 0.90 CNR1 (0.55) CNR1CNR2MARS1NTRK1
SCHEMBL5529104 0.90 CNR1 (0.51) CNR1CNR2MARS1MALT1DHODH
SCHEMBL5524849 0.89 CNR1 (0.54) CNR1CNR2MARS1NTRK1
SCHEMBL5525605 0.88 CNR1 (0.53) CNR1CNR2MARS1NTRK1
SCHEMBL5520051 0.88 CNR1 (0.52) CNR1CNR2MARS1NTRK1
SCHEMBL5526957 0.88 CNR1 (0.52) CNR1CNR2MARS1DHODHNTRK1
SCHEMBL5520963 0.87 CNR1 (0.52) CNR1CNR2MARS1NTRK1
SCHEMBL5526712 0.86 CNR1 (0.55) CNR1CNR2MARS1NTRK1
SCHEMBL5516429 0.85 CNR1 (0.54) CNR1CNR2MARS1NTRK1

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 5 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
CN-1902191-A Amidopyrazole derivative DAIICHI SEIYAKU CO (JP) 2007-01-24 CN 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.