SCHEMBL25293231

SCHEMBL25293231

O=[N+]([O-])c1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
PDPK1 O15530 1/20 0.52
CYTH3 O43739 1/20 0.52
AKT1 P31749 1/20 0.52
MAPT P10636 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
PHGDH O43175 1/20 0.50
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
HTT P42858 2/20 0.48
GAA P10253 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NSD2 O96028 1/20 0.48
ALPL P05186 1/20 0.48
POLB P06746 1/20 0.48
RECQL P46063 1/20 0.48
CASP6 P55212 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
RRM1 P23921 1/20 0.48

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
SCHEMBL25786754 0.86 NPC1 (0.55) NPC1RAB9AMAPTL3MBTL1PHGDH
SCHEMBL25243075 0.83 MAPT (0.55) NPC1RAB9AMAPTL3MBTL1PHGDH
SCHEMBL25293638 0.80 ALDH1A1 (0.53) NPC1PDPK1CYTH3AKT1MAPT
SCHEMBL25253611 0.79 ALDH1A1 (0.57) NPC1RAB9APDPK1CYTH3AKT1
SCHEMBL4346849 0.76 ALDH1A1 (0.68) NPC1RAB9AMAPTKMT2AHTT
SCHEMBL5452586 0.75 MAPT (0.65) NPC1RAB9AMAPTL3MBTL1MEN1
SCHEMBL6815299 0.74 ALDH1A1 (0.58) NPC1RAB9AMAPTL3MBTL1MEN1
SCHEMBL25298861 0.74 EPHX1 (0.61) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL4347512 0.74 KMT2A (0.62) MAPTKMT2AGAAKDM4EALDH1A1
SCHEMBL15347550 0.73 MAPT (0.62) NPC1RAB9AMAPTL3MBTL1MEN1

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-20250100980-A1 NOVEL LEUKOTRIENE B4 RECEPTOR INHIBITORS AND USE THEREOF EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2025-03-27 US disclosed
WO-2023121022-A1 NOVEL LEUKOTRIENE B4 RECEPTOR INHIBITORS AND USE THEREOF 이화여자대학교 산학협력단 2023-06-29 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-20250100980-A1 NOVEL LEUKOTRIENE B4 RECEPTOR INHIBITORS AND USE THEREOF LTB4R2, LTB4R, CYSLTR2 NPC1 1534/4885RAB9A 4301/4885PDPK1 2223/4885

“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.