SCHEMBL21703233

SCHEMBL21703233

Nc1cccn(Cc2cc3cc(F)ccc3n2Cc2ccc(F)cc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 5/20 0.47
CCR2 P41597 1/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 1/20 0.41
PTGS2 P35354 1/20 0.39
CD74 P04233 1/20 0.38
MIF P14174 1/20 0.38
TNIK Q9UKE5 1/20 0.38
TP53 P04637 1/20 0.38
IDO1 P14902 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 2/20 0.37
POLB P06746 1/20 0.36
TYMS P04818 1/20 0.36

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
SCHEMBL21703232 0.95 MAP4K1 (0.49) MAP4K1CCR2MAPTTHRBCD74
SCHEMBL21703228 0.88 MAP4K1 (0.48) MAP4K1MAPTKMT2AMEN1HTT
SCHEMBL23453103 0.87 MAP4K1 (0.49) MAP4K1KMT2AMEN1HTTSMN1; SMN2
SCHEMBL21684756 0.85 MAP4K1 (0.41) MAP4K1TP53SMN1; SMN2
SCHEMBL23452818 0.85 MAP4K1 (0.49) MAP4K1
SCHEMBL21703402 0.84 MAP4K1 (0.42) MAP4K1CCR2MAPTTHRBPTGS2
SCHEMBL21685726 0.83 HCRTR1 (0.47) MAP4K1MAPTTP53IDO1KMT2A
SCHEMBL21703400 0.80 MAP4K1 (0.43) MAP4K1CCR2MAPTCD74MIF
SCHEMBL21703186 0.79 TBXA2R (0.50) MAP4K1
SCHEMBL8077068 0.79 MAPT (0.62) MAPTTHRBTP53KMT2AMEN1

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
EP-4219460-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS Sitari Pharma, Inc. (US) 2023-08-02 EP disclosed
US-11548892-B1 Transglutaminase 2 (TG2) inhibitors SITARI PHARMA, INC. (US) 2023-01-10 US disclosed
US-20210163480-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS SITARI PHARMA, INC. 2021-06-03 US disclosed
WO-2020033784-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS SITARI PHARMA, INC. (US) 2020-02-13 WO 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 (2 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-20210163480-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS TGM2, TGM3, TGM1 MAP4K1 2520/4885CCR2 4318/4885MAPT 353/4885
US-11548892-B1 Transglutaminase 2 (TG2) inhibitors TGM2, TGM3, TGM1 MAP4K1 2520/4885CCR2 4318/4885MAPT 353/4885

“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.