SCHEMBL17048718

SCHEMBL17048718

C[Si](C)(C)OC(C#N)c1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
PSMB8 P28062 5/20 0.34
PSMB5 P28074 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
ALOX15 P16050 2/20 0.31

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
SCHEMBL11147808 0.89 ALDH1A1 (0.49) ALDH1A1GAAPSMB8PSMB5KDM4E
SCHEMBL29723947 0.89 ALDH1A1 (0.49) ALDH1A1GAAPSMB8PSMB5KDM4E
SCHEMBL11042586 0.89 ALDH1A1 (0.49) ALDH1A1GAAPSMB8PSMB5KDM4E
SCHEMBL11041797 0.87 ALDH1A1 (0.36) ALDH1A1GAAKDM4EALOX15
SCHEMBL17048984 0.83 HPGD (0.40) ALDH1A1GAAKDM4E
SCHEMBL6092949 0.83 ALDH1A1 (0.35) ALDH1A1GAAPSMB8PSMB5KDM4E
SCHEMBL2610141 0.82 ALDH1A1 (0.43) ALDH1A1GAAKDM4E
SCHEMBL17048803 0.80 TRPV4 (0.33)
SCHEMBL11043452 0.79 CYP2A6 (0.40) ALDH1A1GAAKDM4EALOX15
SCHEMBL17048800 0.78 MET (0.43) ALDH1A1GAA

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-3110810-B1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LTD (JP) 2018-05-02 EP disclosed
EP-3110810-A1 PYRAZOLE AMIDE DERIVATIVE Teijin Pharma Limited (JP) 2017-01-04 EP disclosed
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
WO-2016044777-A1 HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-03-24 WO disclosed
WO-2016044777-A1 HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-03-24 WO disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US disclosed
WO-2015129926-A1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-09-03 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-20150266824-A1 Pyrazole Amide Derivative RORC, RORB, RORA ALDH1A1 923/4885GAA 3413/4885PSMB8 3184/4885

“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.