SCHEMBL3455040

SCHEMBL3455040

NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.62
LMNA P02545 4/20 0.55
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 4/20 0.51
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
MAPT P10636 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HPGD P15428 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HIF1A Q16665 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TP53 P04637 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
GAA P10253 2/20 0.50

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
Fenclozic Acid SCHEMBL27104 0.86 LMNA (0.73) GFERLMNAKDM4EALDH1A1RAB9A
SCHEMBL11158204 0.85 KDM4E (0.51) LMNAKDM4EALDH1A1RAB9ANPC1
SCHEMBL12608909 0.85 GFER (0.62) GFERLMNAKDM4EALDH1A1RAB9A
SCHEMBL5901574 0.84 KDM4E (0.55) LMNAKDM4EALDH1A1RAB9ANPC1
SCHEMBL5717705 0.84 KDM4E (0.71) LMNAKDM4EALDH1A1RAB9ANPC1
SCHEMBL23780370 0.82 GFER (0.55) GFERLMNAKDM4EALDH1A1RAB9A
SCHEMBL5717700 0.81 KDM4E (0.78) LMNAKDM4EALDH1A1RAB9ANPC1
SCHEMBL27344271 0.81 ALDH1A1 (0.64) GFERLMNAKDM4EALDH1A1RAB9A
SCHEMBL8424253 0.79 TP53 (0.60) GFERLMNAKDM4EALDH1A1RAB9A
SCHEMBL8240059 0.79 SHMT1 (0.60) GFERLMNAKDM4EALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009124371-A9 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S. A. (BR) 2010-12-02 WO claimed
WO-2009124371-A2 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S. A. (BR) 2009-10-15 WO claimed
US-11737463-B2 Pyridine and pyrazine compounds BASF SE (DE) 2023-08-29 US disclosed
US-20210145002-A1 PYRIDINE AND PYRAZINE COMPOUNDS BASF SE (DE) 2021-05-20 US disclosed
EP-1363925-B1 MACROLIDE ANTIBIOTICS GLAXO GROUP LTD (GB) 2006-11-15 EP disclosed
US-20060211636-A1 Macrolide Antibiotics ALIHODZIC SULEJMAN 2006-09-21 US disclosed
US-20050215495-A1 Macrolide antibiotics ALIHODZIC SULEJMAN 2005-09-29 US disclosed
US-20040077557-A1 Macrolide antibiotics GLAXO GROUP LIMITED (GB) 2004-04-22 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 (5 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-11737463-B2 Pyridine and pyrazine compounds NDUFS5, IL5, NDUFS4 GFER 2880/4885LMNA 4043/4885KDM4E 1933/4885
US-20210145002-A1 PYRIDINE AND PYRAZINE COMPOUNDS NDUFS5, IL5, NDUFS4 GFER 2880/4885LMNA 4043/4885KDM4E 1933/4885
US-20050215495-A1 Macrolide antibiotics IL1R1, MRPL12, RPS21 GFER 1608/4885LMNA 1672/4885KDM4E 1204/4885
US-20060211636-A1 Macrolide Antibiotics IL1R1, MRPL12, RPS21 GFER 1608/4885LMNA 1672/4885KDM4E 1204/4885
US-20040077557-A1 Macrolide antibiotics MALT1, MRPL21, IL1R1 GFER 1958/4885LMNA 1504/4885KDM4E 1358/4885

“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.