SCHEMBL4493210

SCHEMBL4493210

CN(C)CCN(C)C(=O)c1cccc(N/C(=C2\C(=O)Nc3cc(C#N)ccc32)c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.41
ATR Q13535 1/20 0.38
MCHR1 Q99705 1/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PARP1 P09874 1/20 0.36
BRAF P15056 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
TLK2 Q86UE8 1/20 0.35
F2 P00734 1/20 0.35
PLG P00747 1/20 0.35
PLAU P00749 1/20 0.35
KLKB1 P03952 1/20 0.35
PRSS1 P07477 1/20 0.35
LMNA P02545 1/20 0.35
STK10 O94804 1/20 0.34
SLK Q9H2G2 1/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL4493214 1.00 EGLN1 (0.41) EGLN1ATRMCHR1ALDH1A1SMN1; SMN2
SCHEMBL4477846 0.92 EGLN1 (0.43) EGLN1ATRMCHR1ADORA2AADORA1
SCHEMBL4477849 0.92 EGLN1 (0.43) EGLN1ATRMCHR1ADORA2AADORA1
SCHEMBL4506506 0.87 EGLN1 (0.45) EGLN1MCHR1F2PLGPLAU
SCHEMBL4506511 0.87 EGLN1 (0.45) EGLN1MCHR1F2PLGPLAU
SCHEMBL4496928 0.87 ATR (0.40) ATRALDH1A1SMN1; SMN2PARP1ADORA2A
SCHEMBL4496932 0.87 ATR (0.40) ATRALDH1A1SMN1; SMN2PARP1ADORA2A
SCHEMBL3848089 0.85 RAB9A (0.42) ATRALDH1A1SMN1; SMN2ADORA2AADORA1
SCHEMBL4497164 0.85 RORC (0.39) EGLN1MCHR1TLK2F2PLG
SCHEMBL4497162 0.85 RORC (0.39) EGLN1MCHR1TLK2F2PLG

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 EGLN1 3456/4885ATR 526/4885MCHR1 666/4885

“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.