SCHEMBL1496352

SCHEMBL1496352

Nc1cccc(NC(=O)c2cccnc2SCc2ccnc3ccccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BLK P51451 2/20 0.51
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACLY P53396 1/20 0.45
KDR P35968 4/20 0.45
PTGS1 P23219 1/20 0.43
GAA P10253 1/20 0.43
DNMT1 P26358 1/20 0.43
CFTR P13569 1/20 0.42
PRKCI P41743 1/20 0.42
PABPC1 P11940 1/20 0.42
EIF4H Q15056 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
OPRL1 P41146 1/20 0.41
NSD2 O96028 1/20 0.41
FLT1 P17948 1/20 0.41

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) ALDH1A1ACLYKDRGAAPRKCI
SCHEMBL1496284 0.88 KDR (0.52) ALDH1A1SMN1; SMN2ACLYKDRGAA
SCHEMBL1496290 0.87 NPC1 (0.55) ALDH1A1SMN1; SMN2ACLYKDRKMT2A
SCHEMBL1496291 0.86 KDM4E (0.47) ALDH1A1SMN1; SMN2ACLYKDRGAA
SCHEMBL1496354 0.86 ACLY (0.43) ALDH1A1ACLYKDRGAAPABPC1
SCHEMBL1496367 0.84 KDR (0.53) ALDH1A1ACLYKDRGAADNMT1
SCHEMBL1496366 0.83 KDR (0.66) ALDH1A1ACLYKDRGAAPABPC1
SCHEMBL1496313 0.82 KDM4E (0.45) BLKALDH1A1ACLYKDRGAA
SCHEMBL1496312 0.82 KMT2A (0.47) BLKALDH1A1ACLYKDRGAA
SCHEMBL1496325 0.82 MEN1 (0.52) ALDH1A1SMN1; SMN2ACLYKDRGAA

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 BLK 1348/4885ALDH1A1 1108/4885SMN1; SMN2 4828/4885

“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.