SCHEMBL17110308

SCHEMBL17110308

Cc1c(C(=O)N(CC(=O)c2c(O)cccc2O)Cc2cc(F)cc(F)c2)cnn1[C@H]1CC[C@H](C(=O)O)CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
HSD11B1 P28845 1/20 0.33
NTRK1 P04629 3/20 0.32
MMP13 P45452 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
BACE1 P56817 3/20 0.31
BACE2 Q9Y5Z0 3/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ACSL1 P33121 1/20 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
SCHEMBL17110303 0.96 ALDH1A1 (0.34) ALDH1A1MAPTMEN1KMT2AHSD11B1
SCHEMBL17110302 0.90 ALDH1A1 (0.33) ALDH1A1MAPTNTRK1
SCHEMBL17098960 0.89 MEN1 (0.32) ALDH1A1MEN1KMT2AHSD11B1OPRM1
SCHEMBL17098547 0.89 MEN1 (0.32) ALDH1A1MEN1KMT2AHSD11B1OPRM1
SCHEMBL17110316 0.88 ALDH1A1 (0.34) ALDH1A1MAPTMEN1KMT2AHSD11B1
SCHEMBL17097866 0.87 ALDH1A1 (0.34) ALDH1A1MAPTMEN1KMT2AHSD11B1
SCHEMBL17097867 0.87 ALDH1A1 (0.34) ALDH1A1MAPTMEN1KMT2AHSD11B1
SCHEMBL17110285 0.85 ALDH1A1 (0.32) ALDH1A1MAPTHSD11B1
SCHEMBL17110306 0.85 ALDH1A1 (0.34) ALDH1A1MAPTHSD11B1MMP13
SCHEMBL17098673 0.84 RORC (0.33) MAPTMEN1KMT2A

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 3584/4885MEN1 4091/4885

“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.