SCHEMBL17110313

SCHEMBL17110313

Cc1c(C(=O)N(CC(=O)c2c(Cl)cccc2[N+](=O)[O-])Cc2cc(F)cc(F)c2)cnn1[C@H]1CC[C@H](C(C)=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KMT2A Q03164 1/20 0.32
P2RX7 Q99572 1/20 0.30
NTRK1 P04629 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
SCHEMBL17110314 0.88 ALDH1A1 (0.32) ALDH1A1MAPTP2RX7NTRK1
SCHEMBL17110315 0.86 ALDH1A1 (0.32) ALDH1A1MAPTKMT2ANTRK1
SCHEMBL17098813 0.84 VCAM1 (0.37) ALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL17098811 0.84 VCAM1 (0.37) ALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL17110302 0.84 ALDH1A1 (0.33) ALDH1A1MAPTNTRK1
SCHEMBL17110287 0.83
SCHEMBL17110316 0.82 ALDH1A1 (0.34) ALDH1A1MAPTSMN1; SMN2KMT2AP2RX7
SCHEMBL17110290 0.82
SCHEMBL17110299 0.82 LPAR1 (0.34) ALDH1A1MAPTKMT2ANTRK1
SCHEMBL17110284 0.80 ALDH1A1 (0.30) ALDH1A1MAPT

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 3584/4885RAB9A 1645/4885

“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.