SCHEMBL17110280

SCHEMBL17110280

CC[Si](CC)(CC)OC(CN(Cc1ccc(F)cc1)C(=O)c1cnn([C@H]2CC[C@H](C(C)=O)CC2)c1C)c1c(Cl)cncc1Cl

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
NR1H4 Q96RI1 1/20 0.31
HSP90AA1 P07900 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL17110293 0.93
SCHEMBL17110281 0.88 ALDH1A1 (0.38) ALDH1A1MAPTNR1H4HSP90AA1MAPK1
SCHEMBL17048900 0.86 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL17097991 0.85 TP53 (0.34) ALDH1A1MAPT
SCHEMBL17097989 0.85 TP53 (0.34) ALDH1A1MAPT
SCHEMBL17110289 0.85
SCHEMBL17110278 0.82 ALDH1A1 (0.39) ALDH1A1MAPTNR1H4HSP90AA1MAPK1
SCHEMBL17110300 0.81 LPAR1 (0.31) ALDH1A1MAPT
SCHEMBL17110292 0.80 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL17110282 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US 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 923/4885MAPT 3584/4885NR1H4 26/4885

“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.