SCHEMBL15033602

SCHEMBL15033602

O=C(NCCOCc1ccccc1)c1ccccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.67
RAB9A P51151 5/20 0.67
POLB P06746 3/20 0.62
SMN1; SMN2 Q16637 4/20 0.58
HPGD P15428 3/20 0.58
HTT P42858 1/20 0.55
SIGMAR1 Q99720 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 1/20 0.52
CYP1A2 P05177 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
SCHEMBL5655209 0.82 NPC1 (0.65) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL8288031 0.80 NPC1 (0.70) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL6356707 0.80 NPC1 (1.00) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL1577945 0.80 SMN1; SMN2 (0.75) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL4769824 0.78 SMN1; SMN2 (0.67) NPC1RAB9ASMN1; SMN2HTTLMNA
SCHEMBL5860823 0.77 NPC1 (0.71) NPC1RAB9APOLBHPGDKMT2A
SCHEMBL2989489 0.77 NPC1 (0.71) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL28107072 0.77 ALDH1A1 (0.51) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL23416782 0.76 TAAR1 (0.46) NPC1RAB9APOLBSMN1; SMN2HPGD
SCHEMBL13033025 0.76 SMN1; SMN2 (0.60) POLBSMN1; SMN2HPGDHTTLMNA

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 NPC1 328/4885RAB9A 2823/4885POLB 1796/4885

“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.