SCHEMBL29798459

SCHEMBL29798459

CCCCN(CCCC)CC(N)Cc1ccc(N)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
CPB2 Q96IY4 10/20 0.42
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 1/20 0.36
GABRA6 Q16445 1/20 0.36
GABRG1 Q8N1C3 1/20 0.36
GABRG3 Q99928 1/20 0.36
GABRQ Q9UN88 1/20 0.36
CPB1 P15086 3/20 0.36
CPA1 P15085 2/20 0.36

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
SCHEMBL29798282 0.73 MAPT (0.42) MAPTCPB2GABRPGABRDGABRA1
SCHEMBL23327043 0.73 MAPT (0.42) MAPTCPB2GABRPGABRDGABRA1
SCHEMBL4154226 0.71 NFKB1 (0.54) MAPTCPB2GABRPGABRDGABRA1
SCHEMBL10723761 0.70 RAB9A (0.54) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL18924321 0.69 CPB2 (0.50) CPB2GABRPGABRDGABRA1GABRB1
SCHEMBL10130836 0.69 CPB2 (0.57) CPB2GABRPGABRDGABRA1GABRB1
SCHEMBL2823763 0.68 RAB9A (0.57) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL13357005 0.68 CPB2 (0.53) CPB2GABRPGABRDGABRA1GABRB1
SCHEMBL294092 0.67 GABRP (0.50) MAPTCPB2GABRPGABRDGABRA1
SCHEMBL5079022 0.67 CPB2 (0.65) MAPTCPB2GABRPGABRDGABRA1

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-11427542-B2 Compounds for treatment of cardiac arrhythmias and heart failure ELEX BIOTECH, INC. (US) 2022-08-30 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-11427542-B2 Compounds for treatment of cardiac arrhythmias and heart failure RYR2, RYR1, CACNA1F MAPT 341/4885CPB2 2953/4885GABRP 888/4885

“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.