SCHEMBL23840331

SCHEMBL23840331

COc1ncc(NC(=O)c2cc(C(F)(F)F)nn2C)cc1S(=O)(=O)Nc1c(C)cccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
CYP3A4 P08684 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PIK3C3 Q8NEB9 1/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
HIF1A Q16665 1/20 0.43
ROCK1 Q13464 1/20 0.42
F10 P00742 4/20 0.41
BRAF P15056 5/20 0.41
RAF1 P04049 4/20 0.41
TRPV1 Q8NER1 1/20 0.41
KDR P35968 1/20 0.40
F2 P00734 2/20 0.40
IDH1 O75874 1/20 0.39
KCNT1 Q5JUK3 1/20 0.39

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
SCHEMBL25485987 0.89 MEN1 (0.46) ALDH1A1PIK3C3MEN1LMNAMAPT
SCHEMBL23840436 0.88 MEN1 (0.45) ALDH1A1CYP3A4HSD17B10PIK3C3POLB
SCHEMBL25485956 0.86 NAMPT (0.52) ALDH1A1CYP3A4HSD17B10PIK3C3POLB
SCHEMBL23840446 0.84 POLB (0.48) ALDH1A1CYP3A4HSD17B10PIK3C3POLB
SCHEMBL23840626 0.84 LCK (0.53) PIK3C3MEN1MAPTKMT2ABRAF
SCHEMBL23840470 0.84 PRMT5 (0.41) ALDH1A1PIK3C3POLBMEN1LMNA
SCHEMBL23840544 0.84 ALDH1A1 (0.47) ALDH1A1HSD17B10PIK3C3MEN1LMNA
SCHEMBL23840355 0.83 MALT1 (0.47) PIK3C3BRAF
SCHEMBL23840634 0.83 PIK3C3 (0.43) PIK3C3BRAFRAF1IDH1
SCHEMBL23840635 0.83 POLB (0.42) ALDH1A1PIK3C3POLBMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159509-A1 PYRIDINESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-05-25 US disclosed
WO-2021188907-A1 PYRIDINESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2021-09-23 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-20230159509-A1 PYRIDINESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF TRAP1, PINK1, PPM1D ALDH1A1 2592/4885CYP3A4 3527/4885HSD17B10 3166/4885

“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.