SCHEMBL29324067

SCHEMBL29324067

Cc1cc2c(cnn2C)nc1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KCNH2 Q12809 1/20 0.30
TRPA1 O75762 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
SCHEMBL31586750 0.75 TDP1 (0.43) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL21809020 0.75 TRPM5 (0.33) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL29419880 0.75 TRPM5 (0.33) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL24609261 0.71 ALDH1A1 (0.31) KDM4EALDH1A1HPGD
SCHEMBL30251875 0.70 ALDH1A1 (0.37) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL23858817 0.70 ALDH1A1 (0.37) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL29324081 0.69 ADORA2A (0.32) KDM4ESMN1; SMN2TRPA1
SCHEMBL17813455 0.68 KDM1A (0.31)
SCHEMBL7928093 0.68 CYP1A2 (0.39) KCNH2
SCHEMBL29419891 0.68 CYP1A2 (0.39) KCNH2

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-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-07-11 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-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP KDM4E 3365/4885ALDH1A1 252/4885GLA 233/4885

“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.