SCHEMBL24637010

SCHEMBL24637010

O=C(NC[C@@H](O)CO)c1ccc(Nc2ncc(-c3cc(F)c(F)cn3)o2)cn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 6/20 0.38
NTRK1 P04629 4/20 0.37
MAP2K2 P36507 1/20 0.36
PRKCZ Q05513 1/20 0.36
IARS2 Q9NSE4 1/20 0.36
SYK P43405 3/20 0.35
MAPK14 Q16539 1/20 0.34
ALOX5 P09917 1/20 0.33
GCGR P47871 1/20 0.33
ULK1 O75385 2/20 0.33

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
SCHEMBL28733697 0.87 VCP (0.40) MAP2K1MAP2K2PRKCZIARS2ALOX5
SCHEMBL29620865 0.87 VCP (0.40) MAP2K1MAP2K2PRKCZIARS2ALOX5
SCHEMBL22925647 0.87 VCP (0.40) MAP2K1MAP2K2PRKCZIARS2ALOX5
SCHEMBL22925767 0.85 MAOB (0.39) MAP2K1NTRK1
SCHEMBL22925620 0.85 ALOX5 (0.47) MAP2K1ALOX5GCGRULK1
SCHEMBL29620962 0.85 ALOX5 (0.47) MAP2K1ALOX5GCGRULK1
SCHEMBL28733627 0.85 ALOX5 (0.47) MAP2K1ALOX5GCGRULK1
Hydrochloric Acid SCHEMBL29620914 0.84 MAOB (0.38) MAP2K1NTRK1
Hydrochloric Acid SCHEMBL28733689 0.84 MAOB (0.38) MAP2K1NTRK1
SCHEMBL22925698 0.84 SCN9A (0.36) NTRK1GCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220274970-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-09-01 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-20220274970-A1 INHIBITOR COMPOUNDS SERPINB1, MMP1, SSB MAP2K1 2869/4885NTRK1 4716/4885MAP2K2 2540/4885

“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.