SCHEMBL2869348

SCHEMBL2869348

CC(C)CN(C(=O)Nc1ccc(-c2cc(O)no2)cc1)c1ccc2nc(S)sc2c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.44
MAPT P10636 2/20 0.38
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SULT1A1 P50225 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2867241 0.88 MAPT (0.43) EPHX2MAPTNPC1RAB9AKDM4E
SCHEMBL2856785 0.85 EPHX2 (0.43) EPHX2MAPTNPC1RAB9AKDM4E
SCHEMBL2866104 0.85 EPHX2 (0.40) EPHX2MAPTNPC1RAB9AKDM4E
SCHEMBL2862154 0.85 EPHX2 (0.34) EPHX2MAPTNPC1RAB9AALDH1A1
SCHEMBL3405134 0.85 EPHX2 (0.33) EPHX2MAPTNPC1RAB9AMEN1
SCHEMBL10042986 0.85 EPHX2 (0.54) EPHX2MAPTNPC1RAB9AKDM4E
SCHEMBL2865945 0.83 EPHX2 (0.46) EPHX2MAPTNPC1RAB9AMEN1
SCHEMBL2861378 0.83 EPHX2 (0.45) EPHX2MAPTNPC1RAB9AKDM4E
SCHEMBL543875 0.82 EPHX2 (0.45) EPHX2MAPT
SCHEMBL2866859 0.82 EPHX2 (0.45) EPHX2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370260-B1 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2010-11-24 EP claimed
US-7709510-B2 Azoles as malonyl-CoA decarboxylase inhibitors useful as metabolic modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-05-04 US claimed
US-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-05-13 US claimed

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-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators ME1, ME3, ME2 EPHX2 1552/4885MAPT 3030/4885NPC1 833/4885

“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.