SCHEMBL21164236

SCHEMBL21164236

CCC(CCCN)NCCCN

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CNR1 P21554 1/20 0.39
ADRA1A P35348 1/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ABCC3 O15438 1/20 0.38
CASP2 P42575 2/20 0.35
CA12 O43570 2/20 0.35
F13A1 P00488 2/20 0.35
CA2 P00918 2/20 0.35
CYP1A2 P05177 2/20 0.35
ALOX15 P16050 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
THPO P40225 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 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
SCHEMBL8654957 0.91 LMNA (0.39) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL21800012 0.89 LMNA (0.38) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL26206 0.88 LMNA (0.44) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL9817625 0.88 DNM1 (0.44) MEN1KMT2ATSHR
SCHEMBL16269713 0.87 GNAI3 (0.41) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL10045268 0.85 CA12 (0.46) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL12814701 0.84 LMNA (0.38) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL6047553 0.84 SLC6A4 (0.32) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL21799889 0.83 SIGMAR1 (0.40) LMNATDP1CNR1ADRA1AKDM4E
Ammonia Solution, Strong SCHEMBL9525661 0.83 SIGMAR1 (0.37) CASP2CA12F13A1CA2CYP1A2

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-10350178-B2 Methods and compositions for treatment of demyelinating diseases PATHOLOGICA LLC (US) 2019-07-16 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 (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-10350178-B2 Methods and compositions for treatment of demyelinating diseases PMP22, MAG, GMFG LMNA 2354/4885TDP1 743/4885CNR1 2968/4885

“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.