SCHEMBL13299692

SCHEMBL13299692

CN(C)c1ccc2nn(-c3ccc(F)cc3)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.59
RAB9A P51151 10/20 0.59
MEN1 O00255 8/20 0.53
KMT2A Q03164 8/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
ALOX5 P09917 1/20 0.47
APP P05067 4/20 0.44
MAPT P10636 6/20 0.44
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 4/20 0.44
TP53 P04637 2/20 0.44
GAA P10253 2/20 0.44
HPGD P15428 2/20 0.44
CASP1 P29466 2/20 0.44
CASP7 P55210 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL3042867 0.90 NPC1 (0.55) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL24458154 0.84 NPC1 (0.59) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL13299383 0.81 ALOX5 (0.50) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL571698 0.80 NPC1 (0.44) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL9704263 0.79 RAB9A (0.57) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL13290986 0.77 ALOX5 (0.50) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL3032584 0.77 NPC1 (0.69) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL3042432 0.77 NPC1 (0.55) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL3041535 0.77 ALOX5 (0.50) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL3048501 0.77 ALOX5 (0.50) NPC1RAB9AMEN1KMT2AL3MBTL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100150833-A1 COMPOUNDS AND AMYLOID PROBES THEREOF FOR THERAPEUTIC AND IMAGING USES MOLECULAR NEUROIMAGING, LLC 2010-06-17 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-20100150833-A1 COMPOUNDS AND AMYLOID PROBES THEREOF FOR THERAPEUTIC AND IMAGING USES APP, BACE1, BACE2 NPC1 160/4885RAB9A 4657/4885MEN1 1639/4885

“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.