SCHEMBL20809783

SCHEMBL20809783

CCCC(C)C(=O)OCc1cnccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
PSMB5 P28074 1/20 0.37
SYK P43405 1/20 0.36
LONP1 P36776 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
NLRP3 Q96P20 3/20 0.35
CYP1A2 P05177 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL19582170 0.79 PSMB5 (0.37) LMNASMN1; SMN2ALDH1A1PSMB5SYK
SCHEMBL19582171 0.79 PSMB5 (0.37) LMNASMN1; SMN2ALDH1A1PSMB5SYK
SCHEMBL11403418 0.78 SYK (0.39) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL10491331 0.77 SYK (0.43) SMN1; SMN2MEN1ALDH1A1KMT2APSMB5
SCHEMBL7304583 0.75 KDM4E (0.44) LMNASMN1; SMN2KMT2APSMB5SYK
SCHEMBL11397020 0.73 KDM4E (0.43) MAPTKMT2APSMB5SYKL3MBTL1
SCHEMBL5535829 0.72 CYP3A4 (0.44) LMNAMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL5544230 0.72 RAB9A (0.48) LMNASMN1; SMN2HTTTDP1CTSK
SCHEMBL12352573 0.71 PGR (0.52) MAPK1LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL7304330 0.71 TYR (0.46) LMNASMN1; SMN2PSMB5LONP1NLRP3

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-11046670-B2 Piperazinyl norbenzomorphan compounds and methods for using the same BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-29 US disclosed
US-20190077789-A1 PIPERAZINYL NORBENZOMORPHAN COMPOUNDS AND METHODS FOR USING THE SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-03-14 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 (2 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-20190077789-A1 PIPERAZINYL NORBENZOMORPHAN COMPOUNDS AND METHODS FOR USING THE SAME GAP43, NCDN, NLN MAPK1 4052/4885LMNA 2290/4885MAPT 588/4885
US-11046670-B2 Piperazinyl norbenzomorphan compounds and methods for using the same GAP43, NCDN, NLN MAPK1 4052/4885LMNA 2290/4885MAPT 588/4885

“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.