SCHEMBL6340308

SCHEMBL6340308

COc1cc2c(cc1OC)C(=CC(C)Nc1ccc(CN3CC[S+]([O-])CC3)cc1)C(=O)N2

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.39
TLK2 Q86UE8 2/20 0.37
ABCB1 P08183 1/20 0.37
PAK1 Q13153 1/20 0.36
ACHE P22303 5/20 0.35
LRRK2 Q5S007 1/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL6337159 0.90 ACHE (0.44) RETTLK2ABCB1ACHE
SCHEMBL6329200 0.89 ACHE (0.45) RETABCB1ACHE
SCHEMBL6336940 0.89 ACHE (0.45) RETABCB1ACHE
SCHEMBL6338869 0.89 RET (0.40) RETTLK2ABCB1PAK1ACHE
SCHEMBL6330985 0.88 PAK1 (0.47) PAK1ACHELRRK2
SCHEMBL6331431 0.88 RET (0.42) RETTLK2ABCB1PAK1ACHE
SCHEMBL6335942 0.84 RET (0.39) RETTLK2ABCB1PAK1ACHE
SCHEMBL6330608 0.83 RET (0.43) RETTLK2ABCB1PAK1ACHE
SCHEMBL6340191 0.81 ACHE (0.42) RETTLK2PAK1ACHE
SCHEMBL6335636 0.81 RET (0.40) RETTLK2ABCB1PAK1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-13 US disclosed
US-6794395-B1 Substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-21 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 (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-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments CCNE1, CDK1, CCNI RET 154/4885TLK2 1364/4885ABCB1 435/4885

“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.