SCHEMBL5893449

SCHEMBL5893449

CC(C)(C)O/C=C1/C(=O)Nc2ccc(-c3ccccc3)cc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.55
MAOB P27338 2/20 0.55
LRRK2 Q5S007 2/20 0.52
RAF1 P04049 1/20 0.52
FLT3 P36888 3/20 0.43
CHEK1 O14757 1/20 0.42
ABL1 P00519 1/20 0.42
RET P07949 1/20 0.42
ALK Q9UM73 1/20 0.42
JAK2 O60674 1/20 0.41
JAK3 P52333 1/20 0.41
SRC P12931 1/20 0.41
AKT2 P31751 1/20 0.41
ERBB2 P04626 3/20 0.41
EGFR P00533 2/20 0.41
IGF1R P08069 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RPS6KA3 P51812 1/20 0.40
BRD4 O60885 2/20 0.40

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
SCHEMBL5893452 1.00 MAOA (0.55) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL5894331 0.78 SMN1; SMN2 (0.65) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL5894336 0.78 SMN1; SMN2 (0.65) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL21792485 0.74 MAOA (0.59) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL3290705 0.73 FLT3 (0.79) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL3283768 0.73 FLT3 (0.79) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL3283766 0.73 FLT3 (0.79) MAOAMAOBLRRK2RAF1FLT3
SCHEMBL2789935 0.72 MAOA (1.00) MAOAMAOBLRRK2RAF1MEN1
SCHEMBL3571882 0.71 TDP2 (0.46) MAOAMAOBLRRK2RAF1CHEK1
SCHEMBL5776369 0.68 LRRK2 (1.00) LRRK2RAF1EGFRMEN1KMT2A

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-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
EP-1009738-B1 SUBSTITUTED OXINDOLE DERIVATIVES AS PROTEIN TYROSINE KINASE AND AS PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LTD (GB) 2004-05-19 EP 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-6541503-B2 Preventing chemotherapy induced alopecia. SMITHKLINE BEECHAM CORPORATION 2003-04-01 US disclosed
US-20030004351-A1 Substituted oxindole derivatives as protein tyrosine kinase and as protein serine/threonine kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2003-01-02 US disclosed
US-6387919-B1 Substituted oxindole derivatives as protein tyrosine kinase and as protein serine/threonine kinase inhibitors GLAXO WELLCOME INC. 2002-05-14 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
EP-1009738-A1 SUBSTITUTED OXINDOLE DERIVATIVES AS PROTEIN TYROSINE KINASE AND AS PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-06-21 EP disclosed
WO-1999015500-A1 SUBSTITUTED OXINDOLE DERIVATIVES AS PROTEIN TYROSINE KINASE AND AS PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-04-01 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 (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 MAOA 3420/4885MAOB 3053/4885LRRK2 731/4885
US-20030004351-A1 Substituted oxindole derivatives as protein tyrosine kinase and as protein serine/threonine kinase inhibitors CDK2, CDK1, CCNI MAOA 3797/4885MAOB 3397/4885LRRK2 780/4885

“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.