SCHEMBL5873968

SCHEMBL5873968

CCOC(=O)c1cnc2c(c1)/C(=C\Nc1cccc(C(N)=O)c1)C(=O)N2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.42
NPC1 O15118 5/20 0.42
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 1/20 0.40
MAP3K11 Q16584 1/20 0.39
ABCB1 P08183 1/20 0.39
HTT P42858 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
BRAF P15056 1/20 0.39
HTR1A P08908 1/20 0.38
HTR1D P28221 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR7 P34969 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL5873969 1.00 RAB9A (0.42) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873757 0.87 ALDH1A1 (0.41) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873760 0.87 ALDH1A1 (0.41) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873766 0.86 ALDH1A1 (0.41) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873763 0.86 ALDH1A1 (0.41) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873743 0.83 ALDH1A1 (0.46) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873740 0.83 ALDH1A1 (0.46) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5428534 0.82 KMT2A (0.47) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5172094 0.82 KMT2A (0.47) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL5873917 0.82 NTRK1 (0.45) RAB9AALDH1A1MAP3K11NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818632-B2 3-(anilinomethylene)oxindoles SMITHKLINE BEECHAM CORPORATION 2004-11-16 US claimed
US-20020099071-A1 Protein tyrosine kinase and protein serin/threonine kinase inhibitory activity; anticancer agents; treating chemotherapy induced alopecia GLENNON KIMBERLEY CAROLINE (US) 2002-07-25 US claimed
US-7129253-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-10-31 US disclosed
US-6818632-B2 3-(anilinomethylene)oxindoles SMITHKLINE BEECHAM CORPORATION 2004-11-16 US disclosed
US-20040191210-A1 Compounds GLENNON KIMBERLEY CAROLINE (US) 2004-09-30 US disclosed
US-6498176-B1 INHIBITING TUMOR GROWTH VIA INHIBITION OF TUMOR-RELATED ANGIOGENESIS SMITHKLINEBEECHAM CORPORATION 2002-12-24 US disclosed
US-20020099071-A1 Protein tyrosine kinase and protein serin/threonine kinase inhibitory activity; anticancer agents; treating chemotherapy induced alopecia GLENNON KIMBERLEY CAROLINE (US) 2002-07-25 US disclosed
US-6350747-B1 PROTEIN SERINE/THREONINE KINASE AND PROTEIN TYROSINE KINASE ENZYME INHIBITORS; ANGIOGENESIS INHIBITORS; ANTITUMOR AND ANTIPROLIFERATIVE AGENTS GLAXO WELLCOME INC. 2002-02-26 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-20040191210-A1 Compounds CDK1, AKT1, RPS6KA1 RAB9A 646/4885NPC1 3881/4885ALDH1A1 3649/4885
US-20020099071-A1 Protein tyrosine kinase and protein serin/threonine kinase inhibitory activity; anticancer agents; treating chemotherapy induced alopecia PRKDC, PRKX, BMX RAB9A 2426/4885NPC1 4728/4885ALDH1A1 4171/4885

“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.