SCHEMBL22957950

SCHEMBL22957950

CCN1CCN(CCN2CCN(C)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.41
PAOX Q6QHF9 1/20 0.40
SIGMAR1 Q99720 4/20 0.38
CHRNA7 P36544 1/20 0.38
MC4R P32245 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RAD52 P43351 1/20 0.35
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 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
SCHEMBL19020372 1.00 KDM1A (0.41) KDM1APAOXSIGMAR1CHRNA7MC4R
SCHEMBL81189 0.94
SCHEMBL14524205 0.94 CHRNA7 (0.41) PAOXSIGMAR1CHRNA7MC4RALDH1A1
SCHEMBL6662807 0.94 CHRNA7 (0.41) PAOXSIGMAR1CHRNA7MC4RALDH1A1
SCHEMBL17616057 0.94 CHRNA7 (0.41) PAOXSIGMAR1CHRNA7MC4RALDH1A1
SCHEMBL2323195 0.94
Hydrochloric Acid SCHEMBL28585027 0.91 CHRNA7 (0.39) PAOXSIGMAR1CHRNA7MC4RALDH1A1
Ammonia Solution, Strong SCHEMBL4938560 0.91 CHRNA7 (0.39) PAOXSIGMAR1CHRNA7MC4RALDH1A1
SCHEMBL6661360 0.91 KDM1A (0.45) KDM1ASIGMAR1CHRNA7ALDH1A1ALOX15
SCHEMBL6143515 0.87 PAOX (0.46) KDM1APAOXSIGMAR1MC4RALOX15

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-10913710-B2 Benzene disulfonamide for the treatment of cancer MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V (DE) 2021-02-09 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-10913710-B2 Benzene disulfonamide for the treatment of cancer DUSP6, DUSP26, RASSF2 KDM1A 3798/4885PAOX 2059/4885SIGMAR1 3729/4885

“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.