SCHEMBL21703232

SCHEMBL21703232

Nc1cccn(Cc2cc3cc(F)ccc3n2Cc2ccccc2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 4/20 0.49
CD74 P04233 1/20 0.44
MIF P14174 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CCR2 P41597 1/20 0.40
MAPT P10636 3/20 0.39
HK1 P19367 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
PLK1 P53350 1/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
BRD4 O60885 1/20 0.38
GAA P10253 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL21703233 0.95 MAP4K1 (0.47) MAP4K1CD74MIFSMN1; SMN2L3MBTL1
SCHEMBL21703228 0.86 MAP4K1 (0.48) MAP4K1SMN1; SMN2L3MBTL1HTTMEN1
SCHEMBL23453103 0.85 MAP4K1 (0.49) MAP4K1SMN1; SMN2L3MBTL1HTTMEN1
SCHEMBL21703400 0.85 MAP4K1 (0.43) MAP4K1CD74MIFHTTCCR2
SCHEMBL23452818 0.83 MAP4K1 (0.49) MAP4K1PLK1
SCHEMBL21684756 0.83 MAP4K1 (0.41) MAP4K1SMN1; SMN2LMNATP53
SCHEMBL21685726 0.81 HCRTR1 (0.47) MAP4K1SMN1; SMN2L3MBTL1HTTMEN1
SCHEMBL21703402 0.80 MAP4K1 (0.42) MAP4K1SMN1; SMN2MEN1KMT2ACCR2
SCHEMBL21684642 0.80 TBXA2R (0.48) MAP4K1PLK1
SCHEMBL21703339 0.78 BRD4 (0.50) CD74MIFSMN1; SMN2L3MBTL1HTT

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 2520/4885CD74 627/4885MIF 3856/4885
US-11548892-B1 Transglutaminase 2 (TG2) inhibitors TGM2, TGM3, TGM1 MAP4K1 2520/4885CD74 627/4885MIF 3856/4885

“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.