SCHEMBL6337189

SCHEMBL6337189

COc1cc2c(cc1OC)C(=CC(C)Nc1ccc(CN(C)C)cc1)C(=O)N2

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.44
TLK2 Q86UE8 3/20 0.43
ACHE P22303 3/20 0.40
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 0.39
PSENEN Q9NZ42 2/20 0.39
FLT3 P36888 2/20 0.39
CHEK1 O14757 1/20 0.39
BRD4 O60885 2/20 0.38
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3B P49841 2/20 0.36
FLT4 P35916 1/20 0.35
KDR P35968 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
SCHEMBL6336551 0.92 RET (0.43) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6331496 0.91 ACHE (0.43) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6338814 0.91 RET (0.43) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6336804 0.90 RET (0.48) RETTLK2ACHEBRD4
SCHEMBL6336784 0.90 RET (0.43) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6337029 0.90 RET (0.43) RETTLK2PSEN1PSEN2APH1B
SCHEMBL6339150 0.89 RET (0.41) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6340156 0.89 RET (0.48) RETTLK2ACHEBRD4
SCHEMBL6329413 0.89 RET (0.44) RETTLK2ACHEPSEN1PSEN2
SCHEMBL6329628 0.88 RET (0.41) RETTLK2PSEN1PSEN2APH1B

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 1364/4885ACHE 3681/4885

“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.