SCHEMBL21703328

SCHEMBL21703328

CC(C)Oc1c(F)c(F)cc2[nH]c(Cn3cccc(N)c3=O)nc12

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 15/20 0.55
ELANE P08246 1/20 0.32
KCNH2 Q12809 1/20 0.32
PDPK1 O15530 1/20 0.31
CHEK1 O14757 1/20 0.31
P2RX3 P56373 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
SCHEMBL21703330 0.84 MAP4K1 (0.43) MAP4K1KCNH2PDPK1
SCHEMBL21703080 0.83 MAP4K1 (0.42) MAP4K1ELANEKCNH2
SCHEMBL21703332 0.83 MAP4K1 (0.55) MAP4K1
SCHEMBL21685623 0.82 MAP4K1 (0.56) MAP4K1
SCHEMBL21703333 0.81 MAP4K1 (0.43) MAP4K1
SCHEMBL31303992 0.73 F10 (0.36) MAP4K1ELANEKCNH2CHEK1
SCHEMBL21684959 0.73 F10 (0.36) MAP4K1ELANEKCNH2CHEK1
SCHEMBL21703001 0.73 MAP4K1 (0.42) MAP4K1ELANECHEK1
SCHEMBL21703152 0.73 MAP4K1 (0.38) MAP4K1ELANECHEK1
SCHEMBL21703026 0.72 MAP4K1 (0.50) MAP4K1ELANECHEK1

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 2520/4885ELANE 2815/4885KCNH2 4602/4885
US-11548892-B1 Transglutaminase 2 (TG2) inhibitors TGM2, TGM3, TGM1 MAP4K1 2520/4885ELANE 2815/4885KCNH2 4602/4885

“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.