SCHEMBL29324081

SCHEMBL29324081

Cc1cc2c(cnn2C)c(C(C)(C)C)n1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.32
ADORA2B P29275 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
ADORA1 P30542 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL23137214 0.75 ADORA2A (0.34) ADORA2AADORA2BKDM4EADORA1
SCHEMBL16626052 0.71 POLB (0.36) ADORA2AADORA2B
SCHEMBL24654997 0.71 KMT2A (0.41) KDM4ECYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL26817446 0.70 PDE2A (0.42) KDM4E
SCHEMBL23858559 0.70 KDM4E (0.43) KDM4ESMN1; SMN2
SCHEMBL29324067 0.69 KDM4E (0.31) KDM4ESMN1; SMN2TRPA1
SCHEMBL25875821 0.67 PDE2A (0.39) KDM4E
SCHEMBL26200048 0.66 CCR4 (0.32) KDM4ECYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL7914279 0.64 CYP1A2 (0.42) CYP1A2TRPA1
SCHEMBL30592308 0.64 ADORA2A (0.38) ADORA2AADORA2BKDM4ECYP1A2CYP3A4

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 ADORA2A 1308/4885ADORA2B 909/4885KDM4E 3365/4885

“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.