SCHEMBL4494384

SCHEMBL4494384

CN1CCC(OC(=O)N(C)c2ccc(N)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 9/20 0.58
CHRM1 P11229 6/20 0.58
CHRM5 P08912 5/20 0.58
CHRM4 P08173 2/20 0.58
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SCN1A P35498 6/20 0.46
SCN2A Q99250 6/20 0.46
SCN3A Q9NY46 6/20 0.46
ALDH1A1 P00352 1/20 0.44
BCHE P06276 1/20 0.41
MLNR O43193 1/20 0.41
CHRM2 P08172 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HRH1 P35367 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2B P41595 1/20 0.41

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
SCHEMBL4493112 0.82 CHRM3 (0.53) CHRM3CHRM1CHRM5CHRM4MEN1
SCHEMBL4501227 0.76 PKM (0.54) ALDH1A1HTR2ADRD3
SCHEMBL4492081 0.75 GAA (0.38) CHRM3CHRM1CHRM5CHRM4KMT2A
SCHEMBL27780541 0.72 CHRM3 (0.54) CHRM3CHRM1CHRM5CHRM4MEN1
SCHEMBL4492860 0.72 GAA (0.49) MEN1KMT2AALDH1A1
SCHEMBL381901 0.71 ALDH1A1 (0.52) MEN1KMT2AALDH1A1
SCHEMBL737365 0.70 ALDH1A1 (0.46) MEN1KMT2AALDH1A1
SCHEMBL27928038 0.70 MAPT (0.50) CHRM3CHRM1CHRM5CHRM4KMT2A
Hydrochloric Acid SCHEMBL28120286 0.70 PKM (0.56) CHRM3CHRM1CHRM5CHRM4MEN1
SCHEMBL1126485 0.69 ALDH1A1 (0.43) MEN1KMT2AALDH1A1HTR2AHTR2C

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 CHRM3 997/4885CHRM1 232/4885CHRM5 922/4885

“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.