SCHEMBL17110549

SCHEMBL17110549

O=C(CN(Cc1ccc(F)cc1)C(=O)c1cnn([C@H]2C[C@@](F)(C(=O)O)C2)c1C(F)(F)F)c1c(Cl)cncc1Cl

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
PTPN1 P18031 1/20 0.33
CCR5 P51681 2/20 0.31
UBE2M P61081 2/20 0.31
DCUN1D1 Q96GG9 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
NR3C1 P04150 1/20 0.30
GAA P10253 2/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL17099203 0.93 ALDH1A1 (0.31) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17099204 0.93 ALDH1A1 (0.31) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17099201 0.93 ALDH1A1 (0.31) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17097761 0.93 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17097762 0.93 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17097764 0.93 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17098423 0.88 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17098422 0.88 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17098424 0.88 ALDH1A1 (0.32) ALDH1A1MAPTPTPN1CCR5UBE2M
SCHEMBL17098897 0.88 ALDH1A1 (0.34) ALDH1A1MAPTPTPN1CCR5PDE4A

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 4 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-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
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 3584/4885PTPN1 1378/4885

“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.