SCHEMBL4495013

SCHEMBL4495013

CN(C)CCN(C(=O)c1ccncc1)c1ccc(N/C(=C2\C(=O)Nc3cc(F)ccc32)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.34
FLT3 P36888 1/20 0.34
NAMPT P43490 2/20 0.34
MAPT P10636 1/20 0.34
RECQL P46063 1/20 0.34
ROCK2 O75116 2/20 0.34
ALDH1A1 P00352 1/20 0.33
ADRB2 P07550 1/20 0.33
MAPK14 Q16539 2/20 0.33
PDPK1 O15530 1/20 0.33
ACHE P22303 1/20 0.33
PDGFRB P09619 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL4495018 1.00 BACE1 (0.37) BACE1KMT2AMEN1KDM4EFLT3
SCHEMBL4499508 0.95 BACE1 (0.41) BACE1KMT2AMEN1FLT3NAMPT
SCHEMBL4499513 0.95 BACE1 (0.41) BACE1KMT2AMEN1FLT3NAMPT
SCHEMBL4495891 0.92 HTT (0.40) BACE1KMT2AMEN1KDM4EFLT3
SCHEMBL4495890 0.92 HTT (0.40) BACE1KMT2AMEN1KDM4EFLT3
SCHEMBL4492743 0.91 BACE1 (0.37) BACE1KMT2AKDM4ENAMPTMAPT
SCHEMBL4492745 0.91 BACE1 (0.37) BACE1KMT2AKDM4ENAMPTMAPT
SCHEMBL4494308 0.88 BACE1 (0.41) BACE1FLT3MAPTALDH1A1ACHE
SCHEMBL6182458 0.88 BACE1 (0.41) BACE1FLT3MAPTALDH1A1ACHE
SCHEMBL4494303 0.88 BACE1 (0.41) BACE1FLT3MAPTALDH1A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 US disclosed
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 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 (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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR BACE1 1615/4885KMT2A 3530/4885MEN1 1288/4885

“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.