SCHEMBL5424397

SCHEMBL5424397

NS(=O)(=O)c1ccc(N/C=C2\C(=O)Nc3ncccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
CA1 P00915 8/20 0.46
CA2 P00918 8/20 0.46
MAPT P10636 3/20 0.43
APP P05067 2/20 0.43
SNCA P37840 2/20 0.43
CA12 O43570 4/20 0.42
CA9 Q16790 4/20 0.42
NT5E P21589 2/20 0.40
CTRC Q99895 1/20 0.40
RAF1 P04049 1/20 0.40
NTRK1 P04629 1/20 0.40
CA7 P43166 1/20 0.39
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
TDP2 O95551 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
SCHEMBL5169141 1.00 L3MBTL1 (0.51) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL5873675 0.83 MAPT (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL5873678 0.83 MAPT (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL8323651 0.81 MAPT (0.64) MAPK1CA1CA2MAPTAPP
SCHEMBL5430345 0.81 ALDH1A1 (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL5169077 0.81 ALDH1A1 (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL5430358 0.80 ALDH1A1 (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL5430362 0.80 ALDH1A1 (0.46) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL7899300 0.80 POLB (0.55) L3MBTL1ALDH1A1PKMHPGDMAPK1
SCHEMBL4994672 0.80 POLB (0.55) L3MBTL1ALDH1A1PKMHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6815439-B2 PYRROLO(2,3-B)PYRIDINE DERIVATIVES AS CYCLIN-DEPENDENT KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2004-11-09 US claimed
US-20040072836-A1 Substituted aza-oxindole derivatives HARRIS PHILIP ANTHONY (US) 2004-04-15 US claimed
EP-1180105-B1 SUBSTITUTED AZA-OXINDOLE DERIVATIVES GLAXO GROUP LTD (GB) 2003-05-14 EP claimed
EP-1364212-B1 THREE HYBRID ASSAY SYSTEM GPC BIOTECH AG (DE) 2011-02-02 EP disclosed
US-20070213403-A1 TAMOXIFEN RESPONSE IN PRE-AND POSTMENOPAUSAL BREAST CANCER PATIENTS FORSKARPATENT I SYD AB (SE) 2007-09-13 US disclosed
US-7105529-B2 Substituted oxindole derivatives as protein tyrosine and as protein serine/threonine kinase inhibitors and compositions and methods of treating chemotherapy and radiation therapy side effects SMITHKLINE BEECHAM CORPORATION (US) 2006-09-12 US disclosed
US-6815439-B2 PYRROLO(2,3-B)PYRIDINE DERIVATIVES AS CYCLIN-DEPENDENT KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2004-11-09 US disclosed
US-20040072836-A1 Substituted aza-oxindole derivatives HARRIS PHILIP ANTHONY (US) 2004-04-15 US disclosed
US-6624171-B1 Useful as cyclin dependent kinase 11 inhibitors, for preventing/reducing the severity of epithelial cytotoxicity side-effects (e.g., alopecia, plantar- palmar syndrome, mucositis) induced by chemotherapy and/or radiation therapy SMITHKLINE BEECHAM CORPORATION 2003-09-23 US disclosed
US-20030069430-A1 Substituted oxindole derivatives as protein tyrosine and as protein serine/threonine kinase inhibitors and compositions and methods of treating chemotherapy and radiation therapy side effects SMITHKLINE BEECHAM CORPORATION 2003-04-10 US disclosed
US-6369086-B1 Substituted oxidole derivatives as protein tyrosine and as protein serine/threonine kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2002-04-09 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 (2 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-20030069430-A1 Substituted oxindole derivatives as protein tyrosine and as protein serine/threonine kinase inhibitors and compositions and methods of treating chemotherapy and radiation therapy side effects SRC, CDK2, CDK1 L3MBTL1 3106/4885ALDH1A1 3290/4885PKM 2084/4885
US-20040072836-A1 Substituted aza-oxindole derivatives CCNI, AZI2, CDKN1A L3MBTL1 3221/4885ALDH1A1 1625/4885PKM 2382/4885

“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.