SCHEMBL829774

SCHEMBL829774

Fc1ccc(Sc2cc(Cl)nc3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.46
ALDH1A1 P00352 2/20 0.43
DHFR P00374 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RHEB Q15382 2/20 0.43
LMNA P02545 3/20 0.41
KDM1A O60341 1/20 0.41
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
DHODH Q02127 1/20 0.40
AURKA O14965 1/20 0.39
SRC P12931 1/20 0.39
GSK3B P49841 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
L3MBTL1 Q9Y468 1/20 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
SCHEMBL830251 0.87 TP53 (0.59) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL830704 0.84 HTT (0.51) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL829690 0.84 KDM1A (0.59) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL830551 0.84 MAPT (0.52) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL829447 0.84 DHFR (0.47) MAPTTP53DHFRKDM1AKDM4E
SCHEMBL829981 0.81 AURKA (0.48) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL828917 0.81 TP53 (0.49) MEN1KMT2AMAPTTP53ALDH1A1
SCHEMBL10630879 0.74 GRM2 (0.58) KMT2AALDH1A1KDM4ESMN1; SMN2MAOA
SCHEMBL27306674 0.74 NCF1 (0.46) MAPTDHFRL3MBTL1
SCHEMBL29091586 0.72 MAOA (0.50) MEN1KMT2AMAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143276-B2 4-thio substituted quinoline and naphthyridine compounds XTL BIOPHARMACEUTICALS LTD. (IL) 2012-03-27 US disclosed
US-8143276-B2 4-thio substituted quinoline and naphthyridine compounds XTL BIOPHARMACEUTICALS LTD. (IL) 2012-03-27 US disclosed
US-8143276-B2 4-thio substituted quinoline and naphthyridine compounds XTL BIOPHARMACEUTICALS LTD. (IL) 2012-03-27 US disclosed
EP-2061466-A2 4-THIO SUBSTITUTED QUINOLINE AND NAPHTHYRIDINE COMPOUNDS Xtl Biopharmaceuticals Ltd. (US) 2009-05-27 EP disclosed
US-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds PRESIDIO PHARMACEUTICALS, INC. 2009-02-26 US disclosed
US-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds PRESIDIO PHARMACEUTICALS, INC. 2009-02-26 US disclosed
US-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds PRESIDIO PHARMACEUTICALS, INC. 2009-02-26 US disclosed
WO-2008024423-A2 4-THIO SUBSTITUTED QUINOLINE AND NAPHTHYRIDINE COMPOUNDS XTL BIOPHARMACEUTICALS LTD. (US) 2008-02-28 WO disclosed
WO-2008024423-A2 4-THIO SUBSTITUTED QUINOLINE AND NAPHTHYRIDINE COMPOUNDS XTL BIOPHARMACEUTICALS LTD. (US) 2008-02-28 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-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds GTF3C4, HNF4A, TENT4A MEN1 3979/4885KMT2A 1907/4885MAPT 2002/4885

“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.