SCHEMBL21940451

SCHEMBL21940451

C1CCCC(CC2CCNCC2)CCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
GBA1 P04062 1/20 0.37
ALDH1A1 P00352 1/20 0.35
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
SLC6A1 P30531 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRB2 P47870 2/20 0.33
SLC6A12 P48065 2/20 0.33
SLC6A11 P48066 2/20 0.33
SLC6A13 Q9NSD5 2/20 0.33
CHRM5 P08912 2/20 0.33
CYP1A2 P05177 1/20 0.33
ADRA2C P18825 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33

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
SCHEMBL2148995 1.00 EPHX1 (0.37) EPHX1GBA1ALDH1A1NOS1NOS2
SCHEMBL8297763 1.00 EPHX1 (0.37) EPHX1GBA1ALDH1A1NOS1NOS2
SCHEMBL1692012 0.97 GBA1 (0.38) EPHX1GBA1MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL38665760 0.94 GBA1 (0.37) EPHX1GBA1SLC6A1GABRA5GABRB2
Piperazine SCHEMBL27857658 0.92 CXCR4 (0.37) EPHX1ALDH1A1NOS1NOS2MEN1
SCHEMBL21371574 0.89 ALDH1A1 (0.42) EPHX1ALDH1A1NOS1NOS2MEN1
SCHEMBL331996 0.88 GBA1 (0.42) GBA1NOS2SLC6A1GABRA5GABRB2
SCHEMBL1241237 0.85 GBA1 (0.41) GBA1SLC6A1GABRA5GABRB2SLC6A12
SCHEMBL7957882 0.83 CYP1A2 (0.44) EPHX1GBA1CYP1A2
SCHEMBL23070439 0.82 CHRM5 (0.43) EPHX1NOS1NOS2MEN1MAPT

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-11208655-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2021-12-28 US disclosed
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-04-16 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-11208655-B2 Functionally-modified oligonucleotides and subunits thereof RTCB, NSUN3, NSUN2 EPHX1 3897/4885GBA1 1117/4885ALDH1A1 3163/4885
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof RTCB, NSUN3, NSUN2 EPHX1 3897/4885GBA1 1117/4885ALDH1A1 3163/4885

“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.