SCHEMBL1496360

SCHEMBL1496360

CC(C)(C)c1ccc(NC(=O)c2cccnc2SCc2ccnc3ccccc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.57
FLT1 P17948 3/20 0.57
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
PABPC1 P11940 1/20 0.48
EIF4H Q15056 1/20 0.48
TRPV1 Q8NER1 4/20 0.48
NR4A1 P22736 1/20 0.43
ESR2 Q92731 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
DNMT1 P26358 1/20 0.43
DNMT3L Q9UJW3 1/20 0.43
DNMT3A Q9Y6K1 1/20 0.43
CFTR P13569 1/20 0.42

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
SCHEMBL1496280 0.89 KDR (0.53) KDRFLT1KMT2AMEN1PABPC1
SCHEMBL1496358 0.88 KDR (0.59) KDRFLT1KMT2AMEN1PABPC1
SCHEMBL1496367 0.88 KDR (0.53) KDRFLT1KMT2AMEN1PABPC1
SCHEMBL1496305 0.87 KDR (0.50) KDRFLT1KMT2AMEN1NR4A1
SCHEMBL1496366 0.87 KDR (0.66) KDRFLT1KMT2AMEN1PABPC1
SCHEMBL1496364 0.86 HTR2C (0.53) KDRFLT1KMT2ANR4A1ESR2
SCHEMBL1496334 0.85 KDR (0.56) KDRKMT2AMEN1TRPV1
SCHEMBL1496273 0.85 KDR (0.48) KDRKMT2AMEN1NR4A1ESR2
SCHEMBL1496291 0.84 KDM4E (0.47) KDRKMT2AMEN1ALDH1A1GAA
SCHEMBL1496313 0.82 KDM4E (0.45) KDRKMT2AMEN1PABPC1EIF4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854787-B1 NOVEL CYCLIC COMPOUND HAVING QUINOLYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2010-09-01 EP claimed
US-20080021064-A1 Novel cyclic compound having quinolylalkylthio group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 US claimed
EP-1854787-A1 NOVEL CYCLIC COMPOUND HAVING QUINOLYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-11-14 EP claimed
US-7897774-B2 Cyclic compound having quinolylalkylthio group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-03-01 US disclosed
EP-1854787-B1 NOVEL CYCLIC COMPOUND HAVING QUINOLYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2010-09-01 EP disclosed
US-20080021064-A1 Novel cyclic compound having quinolylalkylthio group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 US disclosed
EP-1854787-A1 NOVEL CYCLIC COMPOUND HAVING QUINOLYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-11-14 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-20080021064-A1 Novel cyclic compound having quinolylalkylthio group SQOR, QSOX1, SQLE KDR 3463/4885FLT1 2060/4885KMT2A 2435/4885

“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.