SCHEMBL31303992

SCHEMBL31303992

CC(C)(C)Oc1cc(F)cc2[nH]c(Cn3cccc(N)c3=O)nc12

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.36
MAP4K1 Q92918 8/20 0.36
TYMS P04818 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
CHEK1 O14757 1/20 0.31
ELANE P08246 1/20 0.31
KCNH2 Q12809 1/20 0.31
PTGER3 P43115 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RGS12 O14924 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL21684959 1.00 F10 (0.36) F10MAP4K1TYMSMEN1KMT2A
SCHEMBL21685676 0.73 MAP4K1 (0.40) MAP4K1MEN1KMT2ACHEK1ELANE
SCHEMBL21703328 0.73 MAP4K1 (0.55) MAP4K1CHEK1ELANEKCNH2
SCHEMBL21685623 0.73 MAP4K1 (0.56) MAP4K1
SCHEMBL21685451 0.73 DRD4 (0.40) F10MAP4K1TYMSMEN1KMT2A
SCHEMBL23453061 0.72 MAP4K1 (0.39) MAP4K1MEN1KMT2ACHEK1ELANE
SCHEMBL21703330 0.71 MAP4K1 (0.43) MAP4K1KCNH2PTGER3
SCHEMBL23453060 0.71 MAP4K1 (0.38) MAP4K1MEN1KMT2ACHEK1ELANE
SCHEMBL21685318 0.70 F10 (0.37) F10
SCHEMBL21684855 0.70 CHEK1 (0.42) MAP4K1CHEK1ELANEKDM4EALDH1A1

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-20250011324-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS SITARI PHARMA, INC., 2025-01-09 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-20250011324-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS TGM2, TGM3, TGM1 F10 1686/4885MAP4K1 2520/4885TYMS 142/4885

“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.