SCHEMBL21703152

SCHEMBL21703152

Cc1cc2[nH]c(Cn3cccc(N)c3=O)nc2c(CC(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 13/20 0.38
PARP1 P09874 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MAPT P10636 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CHEK1 O14757 1/20 0.32
ELANE P08246 1/20 0.32
TLR7 Q9NYK1 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
SCHEMBL25938179 0.82 MAP4K1 (0.35) MAP4K1PARP1KDM4EMAPTUSP2
SCHEMBL21703026 0.81 MAP4K1 (0.50) MAP4K1PARP1KDM4EMAPTHSD17B10
SCHEMBL21702894 0.79 MAP4K1 (0.36) MAP4K1PARP1ELANE
SCHEMBL21703151 0.78 MAP4K1 (0.41) MAP4K1CHEK1ELANE
SCHEMBL25938865 0.75 MAP4K1 (0.58) MAP4K1
SCHEMBL21703328 0.73 MAP4K1 (0.55) MAP4K1CHEK1ELANE
SCHEMBL23452764 0.72 MAP4K1 (0.42) MAP4K1PARP1KDM4EHPGDCHEK1
SCHEMBL21685422 0.72 MAP4K1 (0.53) MAP4K1PARP1CHEK1ELANE
SCHEMBL21685880 0.72 MAP4K1 (0.42) MAP4K1MAPTCHEK1ELANE
SCHEMBL21703101 0.71 MAP4K1 (0.41) MAP4K1PARP1KDM4EELANE

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 2520/4885PARP1 2945/4885KDM4E 2034/4885
US-11548892-B1 Transglutaminase 2 (TG2) inhibitors TGM2, TGM3, TGM1 MAP4K1 2520/4885PARP1 2945/4885KDM4E 2034/4885

“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.