SCHEMBL23840544

SCHEMBL23840544

COc1ncc(NC(=O)c2ccnn2C)cc1S(=O)(=O)Nc1c(C)cccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NAMPT P43490 1/20 0.47
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
PIK3C3 Q8NEB9 2/20 0.41
PKM P14618 1/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
AHR P35869 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 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
SCHEMBL23840351 0.88 FLT1 (0.41) ALDH1A1SMN1; SMN2NAMPTNPC1RAB9A
SCHEMBL23840543 0.88 PIK3C3 (0.39) ALDH1A1HTTPIK3C3MEN1KMT2A
SCHEMBL25485987 0.87 MEN1 (0.46) ALDH1A1SMN1; SMN2NAMPTPIK3C3MEN1
SCHEMBL23840436 0.86 MEN1 (0.45) ALDH1A1SMN1; SMN2NAMPTHSD17B10HTT
SCHEMBL23840635 0.86 POLB (0.42) ALDH1A1SMN1; SMN2NPC1RAB9AHTT
SCHEMBL23833422 0.85 CBLB (0.42) PIK3C3MEN1KMT2ANTRK1
SCHEMBL23840475 0.85 PIK3C3 (0.42) NPC1RAB9APIK3C3MEN1KMT2A
SCHEMBL25487581 0.85 NPC1 (0.45) SMN1; SMN2NPC1RAB9APIK3C3PKM
SCHEMBL23840470 0.85 PRMT5 (0.41) ALDH1A1SMN1; SMN2RAB9AHTTPIK3C3
SCHEMBL23840445 0.84 PIK3C3 (0.38) ALDH1A1NPC1RAB9APIK3C3KMT2A

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 2592/4885SMN1; SMN2 428/4885NAMPT 1200/4885

“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.