SCHEMBL14758463

SCHEMBL14758463

CC(C)c1ccc(NC(=O)Nc2cnccn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 1.00
NPC1 O15118 3/20 1.00
KMT2A Q03164 5/20 0.76
KDM4E B2RXH2 7/20 0.72
POLB P06746 3/20 0.67
SMN1; SMN2 Q16637 1/20 0.64
MEN1 O00255 2/20 0.62
GAA P10253 1/20 0.58
FFAR2 O15552 1/20 0.55

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
SCHEMBL11115961 0.84 RAB9A (1.00) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL3804620 0.82 RAB9A (0.74) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL14517928 0.80 RAB9A (0.72) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL14517930 0.80 KDM4E (1.00) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL23987239 0.79 RAB9A (0.75) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL5381046 0.79 KDM4E (0.69) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL19707622 0.79 RAB9A (0.76) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL10951643 0.79 NPC1 (0.71) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL2789615 0.79 RAB9A (0.64) RAB9ANPC1KMT2AKDM4EPOLB
SCHEMBL27578667 0.77 RAB9A (0.74) RAB9ANPC1KMT2AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140329863-A1 NOVEL ANTIPRION COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-11-06 US disclosed
US-20140329863-A1 NOVEL ANTIPRION COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-11-06 US disclosed
WO-2013033037-A2 NOVEL ANTIPRION COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-03-07 WO 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-20140329863-A1 NOVEL ANTIPRION COMPOUNDS PRNP, PSEN1, PSEN2 RAB9A 1779/4885NPC1 57/4885KMT2A 4582/4885

“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.