SCHEMBL4483065

SCHEMBL4483065

CN(C)CCN(C(=O)c1ccncc1)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 3/20 0.46
KDM4E B2RXH2 4/20 0.44
KMT2A Q03164 1/20 0.44
PHLPP2 Q6ZVD8 1/20 0.42
PDE10A Q9Y233 3/20 0.41
ALDH1A1 P00352 1/20 0.40
ACHE P22303 1/20 0.40
ADRA2C P18825 1/20 0.39
PDK1 Q15118 2/20 0.38
BCHE P06276 1/20 0.37
LMNA P02545 1/20 0.37
MPO P05164 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2A6 P11509 1/20 0.37
CYP2C19 P33261 1/20 0.37
ROCK2 O75116 1/20 0.36
HTT P42858 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
SCHEMBL3152403 0.85 ADRA2C (0.55) KMT2APHLPP2ALDH1A1ADRA2CPDK1
SCHEMBL3150031 0.84 HTT (0.56) MLYCDKDM4EKMT2AALDH1A1PDK1
SCHEMBL8725847 0.82 ADRA2C (0.55) MLYCDKMT2APHLPP2ALDH1A1ADRA2C
SCHEMBL7290259 0.77 KDM4E (0.59) MLYCDKDM4EKMT2APDE10AALDH1A1
SCHEMBL3142097 0.77 PHLPP2 (0.46) MLYCDKMT2APHLPP2ALDH1A1ACHE
SCHEMBL18455023 0.75 EGFR (0.46) MLYCDPHLPP2ALDH1A1ACHEADRA2C
SCHEMBL4496573 0.75 BCHE (0.50) PHLPP2ACHEBCHELMNACYP1A2
SCHEMBL3146589 0.74 PHLPP2 (0.44) MLYCDPHLPP2ALDH1A1ACHELMNA
SCHEMBL11454666 0.73 ACHE (0.46) MLYCDKDM4EKMT2AACHEBCHE
SCHEMBL3143768 0.73 MLYCD (0.62) MLYCDKDM4EPHLPP2ALDH1A1CYP3A4

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 MLYCD 4039/4885KDM4E 1648/4885KMT2A 3530/4885

“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.