SCHEMBL6453590

SCHEMBL6453590

c1csc(-c2nc[nH]c2-c2cccs2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.43
CHEK1 O14757 1/20 0.43
TP53 P04637 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RPS6KB2 Q9UBS0 2/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 3/20 0.41
CYP3A4 P08684 3/20 0.41
RXFP1 Q9HBX9 1/20 0.40
TDO2 P48775 1/20 0.40
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
ALDH1A1 P00352 3/20 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
SCHEMBL10955026 0.86 KDM4E (0.62) MAPTRPS6KB2MEN1KMT2AKDM4E
SCHEMBL29581148 0.86 MAPT (0.62) MAPTSMN1; SMN2MEN1KMT2ATDP1
SCHEMBL10956622 0.82 IDO1 (0.47) MAPTCHEK1TP53SMN1; SMN2MEN1
SCHEMBL10955154 0.82 MAPT (0.56) MAPTTP53SMN1; SMN2MEN1KMT2A
SCHEMBL11506484 0.82 MAPT (0.45) MAPTCHEK1TP53SMN1; SMN2MEN1
SCHEMBL11270929 0.82 MAPK14 (0.59) MAPTSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL10955191 0.81 KDM4E (0.48) MAPTCHEK1TP53SMN1; SMN2RPS6KB2
SCHEMBL11485920 0.79 MAPT (0.42) MAPTCHEK1SMN1; SMN2RPS6KB2MEN1
SCHEMBL29580819 0.79 MAPT (0.42) MAPTCHEK1TP53SMN1; SMN2MEN1
SCHEMBL10959629 0.78 PDE10A (0.59) MAPTSMN1; SMN2RPS6KB2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050203155-A1 Imidazole compounds and human cellular proteins casein kinase I alpha, delta and epsilon as targets for medical intervention against Hepatitis C Virus infections AXXIMA PHARMACEUTICAL AG. (DE) 2005-09-15 US disclosed
EP-1532118-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS Axxima Pharmaceuticals Aktiengesellschaft (DE) 2005-05-25 EP disclosed
WO-2004005264-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS AXXIMA PHARMACEUTICALS AG (DE) 2004-01-15 WO disclosed
US-4524123-A POLYETHERSILOXANE COPOLYMERS, HIGH MOLECULAR WEIGHT POLYETHYLEN, AND EMULSIFIER AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1985-06-18 US disclosed
US-4159338-A ANTIARTHRITIC, ANALGESIC E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-06-26 US 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-20050203155-A1 Imidazole compounds and human cellular proteins casein kinase I alpha, delta and epsilon as targets for medical intervention against Hepatitis C Virus infections CSNK1G1, CSNK1E, CSNK1D MAPT 1480/4885CHEK1 325/4885TP53 1192/4885

“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.