SCHEMBL26849999

SCHEMBL26849999

CC(C)C(=O)N1CCN(CCCCCCN(C)C)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 3/20 0.42
HRH1 P35367 3/20 0.42
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYP2C19 P33261 1/20 0.39
PAOX Q6QHF9 1/20 0.39
CHRM3 P20309 1/20 0.39
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MTNR1B P49286 1/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
HRH3 Q9Y5N1 2/20 0.35
SLC6A4 P31645 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
SCHEMBL24684879 0.88 HRH2 (0.40) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL26145743 0.87 POLB (0.44) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL19710862 0.82 HRH2 (0.56) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL25509591 0.82 HRH2 (0.56) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL26849993 0.81 GNAI3 (0.43)
SCHEMBL24373154 0.81 HRH2 (0.43) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL26849998 0.81 HRH2 (0.46) HRH2HRH1PAOXCHRM3TP53
SCHEMBL1098791 0.80 HRH2 (0.45) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL23572025 0.80 HRH2 (0.57) HRH2HRH1POLBRXFP1CYP2C19
SCHEMBL1098792 0.80 HRH2 (0.45) HRH2HRH1POLBRXFP1CYP2C19

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-11834458-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2023-12-05 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-11834458-B2 Anti-cancer nuclear hormone receptor-targeting compounds NCOA1, NCOR1, NCOA3 HRH2 2612/4885HRH1 2025/4885POLB 986/4885

“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.