SCHEMBL7130741

SCHEMBL7130741

CC(C)(C)OC(=O)Nc1ccc2nc(N)sc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.58
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KIT P10721 1/20 0.50
CSNK2A2 P19784 1/20 0.49
CSNK2B P67870 1/20 0.49
CSNK2A1 P68400 1/20 0.49
MAP4K4 O95819 1/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
LDHA P00338 2/20 0.48
LCK P06239 4/20 0.47
USP2 O75604 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL16307608 0.90 MAP4K4 (0.59) EPHX2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6093198 0.87 EPHX2 (0.51) EPHX2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL14079744 0.86 LDHA (0.67) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL2055274 0.86 LCK (0.52) NPC1RAB9AMAPTSMN1; SMN2MAP4K4
SCHEMBL30554092 0.82 LDHA (0.46) NPC1RAB9AMAPTMAP4K4LDHA
SCHEMBL20868778 0.82 LDHA (0.46) NPC1RAB9AMAPTMAP4K4LDHA
SCHEMBL558100 0.81 LDHA (0.71) EPHX2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL30554089 0.80 LCK (0.45) EPHX2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL210096 0.79 NPC1 (0.61) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL24104135 0.79 EPHX2 (0.68) EPHX2NPC1RAB9AMAPTSMN1; SMN2

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-20030134859-A1 PPAR-gamma modulator SANKYO COMPANY, LIMITED (JP) 2003-07-17 US disclosed
EP-1277729-A1 PPAR (GAMMA) MODULATORS Sankyo Company, Limited (JP) 2003-01-22 EP 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-20030134859-A1 PPAR-gamma modulator PPARG, PPARA, PPARD EPHX2 3491/4885NPC1 1152/4885RAB9A 1179/4885

“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.