SCHEMBL13412950

SCHEMBL13412950

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

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
CHRNA7 P36544 1/20 0.33
HRH3 Q9Y5N1 3/20 0.31
DAO P14920 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL18536496 0.92
SCHEMBL438502 0.83 SLC6A2 (0.39) ALDH1A1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL13412949 0.82 MC4R (0.38) SLC6A3
SCHEMBL19407706 0.81 SLC6A2 (0.38) ALDH1A1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL18828088 0.81 SLC6A2 (0.38) ALDH1A1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL25725668 0.78 PIK3CD (0.45) KDM4EMAPT
SCHEMBL13412945 0.78 KDM4E (0.34) KDM4EALDH1A1MAPTCHRNA7
SCHEMBL681912 0.76 CHRNA7 (0.46) KDM4EALDH1A1MAPTPKMCHRNA7
SCHEMBL13290572 0.76 CHRNA7 (0.46) KDM4EALDH1A1MAPTPKMCHRNA7
SCHEMBL13290568 0.76 CHRNA7 (0.46) KDM4EALDH1A1MAPTPKMCHRNA7

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-20100055183-A1 TRIMEPRAZINE AND ETHOPROPAZINE DERIVATIVES FOR PROMOTING BONE GROWTH OSTEOGENEX INC. (US) 2010-03-04 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-20100055183-A1 TRIMEPRAZINE AND ETHOPROPAZINE DERIVATIVES FOR PROMOTING BONE GROWTH IGFBP5, BMP2, HGF KDM4E 216/4885ALDH1A1 1534/4885MAPT 4437/4885

“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.