SCHEMBL25370002

SCHEMBL25370002

O=C(O)Nc1nc2cc(Sc3ccc(N4CCOCC4)cc3)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
CYP1A2 P05177 2/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
MAPK14 Q16539 1/20 0.44
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 2/20 0.43
MAPK1 P28482 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
RGS12 O14924 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
LRRK2 Q5S007 1/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL25368425 0.91 CYP1A2 (0.46) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL24359614 0.89 LMNA (0.57) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL29600824 0.89 LMNA (0.57) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26131369 0.88 LMNA (0.46) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26111717 0.88 LMNA (0.43) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26112205 0.88 KMT2A (0.40) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26114020 0.88 CYP1A2 (0.43) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26111068 0.88 LMNA (0.43) MEN1KMT2ACYP1A2NR1I2LMNA
Hydrochloric Acid SCHEMBL26128281 0.88 LMNA (0.45) MEN1KMT2ACYP1A2NR1I2LMNA
SCHEMBL26110925 0.87 MEN1 (0.44) MEN1KMT2ACYP1A2NR1I2LMNA

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
US-20230391753-A1 THIOBENZIMIDAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2023-12-07 US disclosed
WO-2023191533-A1 THIOBENZIMIDAZOLE DERIVATIVE PREPARATION METHOD AND NOVEL INTERMEDIATE THEREFOR 고려대학교 산학협력단 2023-10-05 WO disclosed
EP-4230204-A1 THIOBENZIMIDAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF Korea University Research and Business Foundation (KR) 2023-08-23 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-20230391753-A1 THIOBENZIMIDAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF TUBB3, TUBB, TUBB1 MEN1 4314/4885KMT2A 2368/4885CYP1A2 3622/4885

“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.