SCHEMBL29330288

SCHEMBL29330288

Cc1[nH]c(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ TYR P14679 1/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ATP2A2 P16615 1/20 0.35
▸ ATP2A3 Q93084 1/20 0.35
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ DAO P14920 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ NOTUM Q6P988 1/20 0.31

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
SCHEMBL12402395 0.82 ALDH1A1 (0.37) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL7623372 0.77 KDM4E (0.34) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL1791619 0.75 ALDH1A1 (0.38) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL21719469 0.73 ALDH1A1 (0.34) ALDH1A1KDM4ESMN1; SMN2CA2POLB
SCHEMBL1794431 0.73 ALDH1A1 (0.37) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29330322 0.71 KDM4E (0.35) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL13487954 0.70 DAO (0.33) ALDH1A1DAO
SCHEMBL28916527 0.69 — —
SCHEMBL16418933 0.67 NOTUM (0.70) ALDH1A1KDM4EGAAHPGDDAO
SCHEMBL18701493 0.67 CA1 (0.43) ALDH1A1KDM4EGLAGAAHPGD

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-12043613-B2 Inhibitors of SARM1 DISARM THERAPEUTICS, INC. (US) 2024-07-23 — — 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-12043613-B2 Inhibitors of SARM1 SARM1, SMN1; SMN2, SARNP ALDH1A1 4157/4885KDM4E 3087/4885GLA 3399/4885

“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.

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