SCHEMBL476397

SCHEMBL476397

CCOC(=O)c1cc(S(=O)(=O)c2cccc(C)c2)n(-c2cccnc2F)n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.40
ELANE P08246 3/20 0.39
CA9 Q16790 2/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
TP53 P04637 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.37
NR1H2 P55055 1/20 0.37
GAA P10253 1/20 0.37
HTR6 P50406 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
SCHEMBL3691249 0.91 CA9 (0.46) CHRNA7CA9MAPTSMN1; SMN2NPC1
SCHEMBL476334 0.91 CHRNA7 (0.39) CHRNA7ELANECA9MAPTNPC1
SCHEMBL3694089 0.90 NFE2L2 (0.41) CHRNA7ELANECA9MAPTTHRB
SCHEMBL476450 0.89 CHRNA7 (0.50) CHRNA7CA9THRBTP53KMT2A
SCHEMBL476502 0.86 TP53 (0.45) CHRNA7CA9SMN1; SMN2HPGDTP53
SCHEMBL476363 0.81 HTR6 (0.39) CA9KMT2AMEN1ALDH1A1PKM
SCHEMBL3707095 0.80 CA9 (0.46) CHRNA7CA9MAPTTHRBTP53
SCHEMBL3698618 0.79 TP53 (0.52) CHRNA7CA9MAPTSMN1; SMN2NPC1
SCHEMBL476470 0.79 HTR6 (0.36) ELANEKMT2AMEN1ALDH1A1GAA
SCHEMBL476340 0.78 TP53 (0.45) CHRNA7MAPTTHRBHPGDTP53

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2412713-B1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL (JP) 2016-11-30 EP disclosed
US-8895588-B2 Pyrazole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-25 US disclosed
US-8895588-B2 Pyrazole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-25 US disclosed
US-8895588-B2 Pyrazole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-25 US disclosed
US-20120095057-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-19 US disclosed
US-20120095057-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-19 US disclosed
US-20120095057-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-19 US disclosed
EP-2412713-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2012-02-01 EP disclosed
WO-2010110378-A1 PYRAZOLE COMPOUND 武田薬品工業株式会社 (JP) 2010-09-30 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-20120095057-A1 PYRAZOLE COMPOUND CEL, HRH2, GIPR CHRNA7 2192/4885ELANE 270/4885CA9 913/4885

“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.