SCHEMBL492775

SCHEMBL492775

CN(C)C(c1ccccc1)C1CCC(NC(=O)COCCN(C2CC2)S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 3/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
ESR2 Q92731 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PSEN1 P49768 2/20 0.33
PSEN2 P49810 2/20 0.33

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
SCHEMBL492815 0.92 BDKRB1 (0.36) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL493100 0.92 ALDH1A1 (0.35) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL493265 0.87 BDKRB1 (0.35) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL493184 0.85 POLB (0.36) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL492955 0.85 BDKRB1 (0.41) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL493402 0.85 KMT2A (0.37) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL492976 0.84 ALDH1A1 (0.37) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL492458 0.84 MAPT (0.38) ALDH1A1KMT2AHPGDMAPTGAA
SCHEMBL492948 0.84 LMNA (0.37) ALDH1A1HPGDPOLBMAPTGAA
SCHEMBL493102 0.84 L3MBTL1 (0.34) ALDH1A1KMT2AHPGDPOLBMAPT

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-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US claimed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US claimed
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD ALDH1A1 1349/4885KMT2A 1749/4885HPGD 213/4885

“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.