SCHEMBL25700799

SCHEMBL25700799

CC(CCN1CCN(C)CC1)N1CCN(C)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MC4R P32245 2/20 0.35
PAOX Q6QHF9 1/20 0.34
KDM1A O60341 3/20 0.33
KCNH2 Q12809 2/20 0.33
KCNJ1 P48048 1/20 0.33
GLA P06280 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
CYP2D6 P10635 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
DRD1 P21728 1/20 0.32

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
SCHEMBL25730522 0.94 KDM4E (0.40) KDM4EMEN1KMT2AMC4RPAOX
SCHEMBL19356005 0.86 KDM1A (0.36) KDM4EMEN1KMT2AKDM1ACYP2D6
SCHEMBL22326393 0.82 MAOB (0.42) KDM4EMEN1KMT2APAOXKDM1A
SCHEMBL18897641 0.82 MAOB (0.42) KDM4EMEN1KMT2APAOXKDM1A
SCHEMBL26381190 0.81 PAOX (0.36) KDM4EMEN1KMT2APAOXKDM1A
SCHEMBL21577667 0.79 HRH3 (0.40) KDM4EMEN1KMT2AKDM1ASIGMAR1
SCHEMBL21540074 0.79 KDM4E (0.40) KDM4EMEN1KMT2AMC4RGLA
SCHEMBL23132687 0.79 MC4R (0.36) KDM4EMEN1KMT2AMC4RKDM1A
SCHEMBL22130933 0.79 MC4R (0.36) KDM4EMEN1KMT2AMC4RKCNH2
SCHEMBL13881902 0.79 MC4R (0.36) KDM4EMEN1KMT2AMC4RKCNH2

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-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 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-11673879-B2 Substituted pyrimidines and methods of use ALK, TYMP, ENTPD5 KDM4E 2026/4885MEN1 4071/4885KMT2A 3556/4885

“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.