SCHEMBL6330845

SCHEMBL6330845

COc1cc2c(cc1OC)C(=CC(C)Nc1ccc(CNC3CCCCC3)cc1)C(=O)N2

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 3/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.40
RET P07949 4/20 0.40
KCNH2 Q12809 3/20 0.38
TLK2 Q86UE8 2/20 0.38
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.37
GRIN2B Q13224 1/20 0.37
HPGD P15428 1/20 0.36

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
SCHEMBL6333166 0.86 RET (0.44) RETKCNH2TLK2
SCHEMBL6778312 0.85 RET (0.45) RETTLK2
SCHEMBL6335636 0.84 RET (0.40) RETTLK2
SCHEMBL6338486 0.83 RET (0.43) RETTLK2
SCHEMBL6337237 0.82 RET (0.43) MEN1KMT2ARETTLK2
SCHEMBL6329680 0.82 RET (0.49) MEN1KMT2AKDM4EALDH1A1RET
SCHEMBL6337189 0.82 RET (0.44) RETTLK2
SCHEMBL6329102 0.82 RET (0.45) RETTLK2
SCHEMBL6329200 0.82 ACHE (0.45) RET
SCHEMBL6336940 0.82 ACHE (0.45) RET

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 MEN1 1645/4885KMT2A 1678/4885KDM4E 221/4885

“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.