SCHEMBL15033593

SCHEMBL15033593

COCCCNC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.62
ALDH1A1 P00352 5/20 0.60
GAA P10253 1/20 0.57
RECQL P46063 1/20 0.57
HSD17B10 Q99714 3/20 0.51
KMT2A Q03164 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GLA P06280 1/20 0.50
LMNA P02545 1/20 0.50
PTGS2 P35354 1/20 0.49
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL15038349 0.86 HPGD (0.61) HPGDALDH1A1POLBHTTKDM4E
SCHEMBL15038350 0.82 ALDH1A1 (0.65) HPGDALDH1A1GAAPOLBKDM4E
SCHEMBL8239624 0.80 HPGD (0.54) HPGDALDH1A1HSD17B10KMT2ACYP1A2
SCHEMBL10289215 0.80 ALDH1A1 (0.57) HPGDALDH1A1RECQLHSD17B10KMT2A
SCHEMBL15033595 0.79 HPGD (0.55) HPGDALDH1A1HSD17B10KMT2APOLB
SCHEMBL7853870 0.78 HPGD (0.51) HPGDALDH1A1CYP2C19GLA
SCHEMBL7541875 0.78 TAS1R3 (0.47) HPGDALDH1A1
SCHEMBL9721581 0.78 ALDH1A1 (0.59) HPGDALDH1A1GAAKMT2APOLB
SCHEMBL15033599 0.77 ALDH1A1 (0.54) HPGDALDH1A1GAAKMT2ALMNA
SCHEMBL8280364 0.77 GLA (0.63) HPGDALDH1A1GAAHSD17B10KMT2A

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 4152/4885GAA 238/4885

“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.