SCHEMBL4506035

SCHEMBL4506035

CN(C)CCN(c1ccc(N/C(=C2\C(=O)Nc3cc(Br)ccc32)c2ccccc2)cc1)S(=O)(=O)Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.37
NAMPT P43490 2/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 3/20 0.33
HTT P42858 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
PTPN11 Q06124 1/20 0.32
SIRT2 Q8IXJ6 2/20 0.32
SIRT1 Q96EB6 2/20 0.32
MMP2 P08253 1/20 0.32

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
SCHEMBL4506037 1.00 RORC (0.37) RORCNAMPTTHRBMEN1KMT2A
SCHEMBL4502856 0.91 RORC (0.37) RORCNAMPTMEN1KMT2AKDM4E
SCHEMBL4485545 0.91 RORC (0.37) RORCNAMPTMEN1KMT2AKDM4E
SCHEMBL4502853 0.91 RORC (0.37) RORCNAMPTMEN1KMT2AKDM4E
SCHEMBL4485541 0.91 RORC (0.37) RORCNAMPTMEN1KMT2AKDM4E
SCHEMBL4484435 0.91 MEN1 (0.34) THRBMEN1KMT2AKDM4EPOLB
SCHEMBL4484433 0.91 MEN1 (0.34) THRBMEN1KMT2AKDM4EPOLB
SCHEMBL4485044 0.91 KMT2A (0.35) THRBMEN1KMT2AKDM4EPOLB
SCHEMBL4485046 0.91 KMT2A (0.35) THRBMEN1KMT2AKDM4EPOLB
SCHEMBL6321050 0.91 RORC (0.40) RORCNAMPTMEN1KMT2AKDM4E

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-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

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 RORC 309/4885NAMPT 3483/4885THRB 396/4885

“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.