SCHEMBL15033595

SCHEMBL15033595

CN(C)CCCNC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.55
ALDH1A1 P00352 4/20 0.54
ALOX15 P16050 1/20 0.53
SIGMAR1 Q99720 2/20 0.51
TMEM97 Q5BJF2 1/20 0.51
CXCL8 P10145 1/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
KDM4E B2RXH2 3/20 0.48
KCNH2 Q12809 1/20 0.47
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL15033601 0.90 MAPK1 (0.59) HPGDALDH1A1SIGMAR1TMEM97MEN1
SCHEMBL15033599 0.85 ALDH1A1 (0.54) HPGDALDH1A1ALOX15SIGMAR1TMEM97
SCHEMBL15038349 0.85 HPGD (0.61) HPGDALDH1A1POLBKDM4EHTT
SCHEMBL2014524 0.81 HTT (0.52) HPGDALDH1A1ALOX15SIGMAR1TMEM97
SCHEMBL15038350 0.81 ALDH1A1 (0.65) HPGDALDH1A1POLBKDM4E
SCHEMBL15033593 0.79 HPGD (0.62) HPGDALDH1A1KMT2APOLBKDM4E
SCHEMBL8239624 0.79 HPGD (0.54) HPGDALDH1A1MEN1KMT2APOLB
SCHEMBL10289215 0.78 ALDH1A1 (0.57) HPGDALDH1A1KMT2APOLBHTT
SCHEMBL7506575 0.77 HPGD (0.47) HPGDALDH1A1ALOX15MEN1KMT2A
SCHEMBL14454105 0.77 HPGD (0.47) HPGDALDH1A1ALOX15MEN1KMT2A

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-20130158112-A1 COMPOSITIONS AND METHODS FOR INHIBITING BETA AMYLOID SECRETION CASE WESTERN RESERVE UNIVERSITY 2013-06-20 US disclosed
US-20130158112-A1 COMPOSITIONS AND METHODS FOR INHIBITING BETA AMYLOID SECRETION CASE WESTERN RESERVE UNIVERSITY 2013-06-20 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-20130158112-A1 COMPOSITIONS AND METHODS FOR INHIBITING BETA AMYLOID SECRETION IAPP, APP, BACE1 HPGD 3327/4885ALDH1A1 4152/4885ALOX15 1474/4885

“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.