SCHEMBL29329052

SCHEMBL29329052

CC(C)C(C)C(C)N1CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.37
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PKM P14618 1/20 0.32
KCNH2 Q12809 1/20 0.32
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
DPP4 P27487 1/20 0.31
MGLL Q99685 1/20 0.31
USP2 O75604 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
SCHEMBL18909506 0.84 KCNA5 (0.39) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL22879264 0.84 KCNA5 (0.39) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL10232877 0.84 KCNA5 (0.39) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL13066097 0.84 KCNA5 (0.37) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL23103016 0.75 KCNA5 (0.33) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL21447274 0.75 ALDH1A1 (0.35) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL22854206 0.75 KCNA5 (0.33) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL13024056 0.74 KCNA5 (0.39) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL24827726 0.73 MC4R (0.36) KCNA5ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL57306 0.73

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-12037344-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC (US) 2024-07-16 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-12037344-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD KCNA5 2736/4885ALDH1A1 843/4885KMT2A 4247/4885

“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.