SCHEMBL6754503

SCHEMBL6754503

CCC(=O)NCCN(C)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 9/20 0.60
SIGMAR1 Q99720 8/20 0.60
ACKR3 P25106 3/20 0.58
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RAB9A P51151 2/20 0.52
APP P05067 2/20 0.52
MAPT P10636 1/20 0.52
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51

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
SCHEMBL8781086 0.86 MTNR1A (0.52) ACKR3APPMTNR1AMTNR1B
SCHEMBL13135957 0.84 SIGMAR1 (0.63) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL18052439 0.82 L3MBTL1 (0.48) TMEM97SIGMAR1MAPT
SCHEMBL13115918 0.80 SIGMAR1 (0.59) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL17117270 0.79 MEN1 (0.64) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL17086584 0.79 SIGMAR1 (0.58) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL15348637 0.79 SIGMAR1 (0.58) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL24029812 0.78 TMEM97 (0.56) TMEM97SIGMAR1ACKR3MEN1KMT2A
SCHEMBL13302989 0.78 SIGMAR1 (0.56) TMEM97SIGMAR1MEN1KMT2ARAB9A
SCHEMBL9777548 0.78 TMEM97 (0.60) TMEM97SIGMAR1ACKR3MEN1KMT2A

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-20040044053-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US claimed
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US claimed
US-6638965-B2 Antitumor agents BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-10-28 US claimed
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-04-10 US claimed

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 TMEM97 2317/4885SIGMAR1 1330/4885ACKR3 4208/4885
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, MKI67, CSNK1A1 TMEM97 2317/4885SIGMAR1 1330/4885ACKR3 4208/4885
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, CSNK1A1, MKI67 TMEM97 3193/4885SIGMAR1 1815/4885ACKR3 4371/4885

“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.