SCHEMBL8697289

SCHEMBL8697289

O=C(Cl)c1cnc(C(F)(F)F)nc1Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 12/20 0.41
JUN P05412 7/20 0.41
NFKB2 Q00653 7/20 0.41
RELA Q04206 7/20 0.41
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
ATF1 P18846 6/20 0.36
FOS P01100 3/20 0.36
PDE4B Q07343 4/20 0.36
PDE4A P27815 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE11A Q9HCR9 1/20 0.36
XPO1 O14980 4/20 0.35
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33

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
SCHEMBL4415725 0.86 KEAP1 (0.44) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL26150387 0.84 NFKB1 (0.40) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL28874828 0.80 MAPT (0.44) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL30574458 0.77 NFKB1 (0.58) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL131646 0.77 NFKB1 (0.58) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL31469871 0.75 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1
SCHEMBL429969 0.75 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1
SCHEMBL16742964 0.72 PTGDR2 (0.42) ALDH1A1KMT2A
SCHEMBL10585289 0.72 ALDH1A1 (0.38) NFKB1JUNNFKB2RELAALDH1A1
SCHEMBL79014 0.71 NFKB1 (0.60) NFKB1JUNNFKB2RELAATF1

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
US-20260132127-A1 NOVEL SPIRO COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2026-05-14 US disclosed
CN-118176179-A Novel spiro compounds 田边三菱制药株式会社 2024-06-11 CN disclosed
WO-2023074847-A1 NOVEL SPIRO COMPOUND 田辺三菱製薬株式会社 2023-05-04 WO disclosed
US-5852028-A Pyrimidine carboxylates and related compounds and methods for treating inflammatory conditions SIGNAL PHARMACEUTICALS, INC. (US) 1998-12-22 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-20260132127-A1 NOVEL SPIRO COMPOUND TRHR, NR3C2, THRB NFKB1 2906/4885JUN 4129/4885NFKB2 2381/4885

“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.