SCHEMBL25319948

SCHEMBL25319948

NCc1ccncc1OCc1ncccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
AOC1 P19801 4/20 0.36
AOC3 Q16853 4/20 0.36
MAOB P27338 2/20 0.36
NOTUM Q6P988 1/20 0.36
CXCR4 P61073 1/20 0.35
IDO1 P14902 2/20 0.34
SYK P43405 2/20 0.34
SSTR4 P31391 1/20 0.33
ADORA2A P29274 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
SCHEMBL29529970 0.83 LOXL2 (0.49) SGMS2LOXL2AOC1AOC3MAOB
SCHEMBL25321326 0.83 LOXL2 (0.49) SGMS2LOXL2AOC1AOC3MAOB
SCHEMBL29102338 0.79 SGMS2 (0.38) SGMS2NOTUMSSTR4ADORA2A
SCHEMBL29530269 0.79 FEN1 (0.38) SGMS2NOTUM
SCHEMBL29529544 0.79 FEN1 (0.38) SGMS2NOTUM
SCHEMBL25321126 0.79 FEN1 (0.38) SGMS2NOTUM
SCHEMBL17371994 0.76 LOXL2 (0.49) LOXL2AOC1AOC3
SCHEMBL2301406 0.74 CXCR4 (0.45) LOXL2MAOBCXCR4IDO1SSTR4
SCHEMBL17962479 0.74 LOXL2 (0.46) LOXL2AOC1AOC3
Hydrochloric Acid SCHEMBL16240453 0.72 CXCR4 (0.44) LOXL2MAOBCXCR4IDO1SSTR4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
EP-4217070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Scorpion Therapeutics, Inc. (US) 2023-08-02 EP disclosed
WO-2022066734-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER SCORPION THERAPEUTICS, INC. (US) 2022-03-31 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 (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-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ERBB2, EGFR, ERBB3 SGMS2 2850/4885LOXL2 1565/4885AOC1 1586/4885

“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.