SCHEMBL5625337

SCHEMBL5625337

Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.75
LMNA P02545 2/20 0.69
ALDH1A1 P00352 1/20 0.68
POLB P06746 1/20 0.66
MC4R P32245 1/20 0.62
DRD4 P21917 1/20 0.60
KMT2A Q03164 1/20 0.59
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
CCR3 P51677 1/20 0.55

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
SCHEMBL10690328 0.91 LMNA (0.80) SIGMAR1LMNAALDH1A1POLBMC4R
SCHEMBL654308 0.87 DRD4 (0.77) SIGMAR1LMNADRD4
SCHEMBL1711188 0.87 DRD4 (0.77) SIGMAR1LMNAALDH1A1DRD4
SCHEMBL1415730 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
SCHEMBL2489199 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
SCHEMBL1041303 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
SCHEMBL8188324 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
SCHEMBL576868 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
SCHEMBL242970 0.87 SIGMAR1 (1.00) SIGMAR1LMNAPOLBMC4RDRD4
Hydrochloric Acid SCHEMBL9742129 0.86 DRD4 (0.74) SIGMAR1LMNADRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166615-B2 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-23 US disclosed
US-7160901-B2 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-09 US disclosed
US-20040044053-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US disclosed
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US disclosed
US-6638965-B2 Antitumor agents BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-10-28 US disclosed
EP-1341760-A1 SULFONYLAMINO SUBSTITUTED 3-(AMINOMETHYLIDE)-2-INDOLINONES AS CELL PROLIFERATION INHIBITORS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-09-10 EP disclosed
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-04-10 US disclosed
WO-2002036564-A1 SULFONYLAMINO SUBSTITUTED 3-(AMINOMETHYLIDE)-2-INDOLINONES AS CELL PROLIFERATION INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-05-10 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 (3 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-20040044053-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, MKI67, CSNK1A1 SIGMAR1 1330/4885LMNA 1494/4885ALDH1A1 1242/4885
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, MKI67, CSNK1A1 SIGMAR1 1330/4885LMNA 1494/4885ALDH1A1 1242/4885
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, CSNK1A1, MKI67 SIGMAR1 1815/4885LMNA 773/4885ALDH1A1 1477/4885

“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.