SCHEMBL10170020

SCHEMBL10170020

CC(C)NCCOC1CCCCO1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4C Q9H3R0 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
P2RX3 P56373 4/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL23308070 0.91 MEN1 (0.36) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL28984683 0.90 MEN1 (0.43) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL28721648 0.82 MEN1 (0.36) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8074011 0.82 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL12085983 0.79 MEN1 (0.39) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8157989 0.79 MEN1 (0.39) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8295974 0.79 MEN1 (0.39) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8865823 0.79 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL14672112 0.79 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL22142891 0.78 MEN1 (0.38) MEN1KMT2AKDM4CNPC1RAB9A

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
WO-2020132384-A1 THIENOPYRIDINE INHIBITORS OF RIPK2 CELGENE CORPORATION (US) 2020-06-25 WO disclosed
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2012-02-23 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-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES ITGAL, ITGA1, ITGA5 MEN1 3171/4885KMT2A 1129/4885KDM4C 463/4885

“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.