SCHEMBL24656166

SCHEMBL24656166

COc1cccc2c(C(C)C)cnn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 0.39
PDE3A Q14432 5/20 0.33
PDE5A O76074 2/20 0.32
NPBWR1 P48145 1/20 0.32
CASR P41180 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
MEN1 O00255 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
FAAH O00519 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 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
SCHEMBL26052083 0.79 FAAH (0.32) PDE4BCYP1A2CYP3A4FAAHCA1
SCHEMBL23132317 0.77 DRD2 (0.38) CASRCYP1A2CYP3A4FAAHCA1
SCHEMBL21893906 0.77 PDE4B (0.33) PDE4BPDE3ACYP1A2MEN1KMT2A
SCHEMBL27752780 0.76 PDE4B (0.33) PDE4BPDE3AMEN1KMT2APTGS1
SCHEMBL24391815 0.75 PDE4B (0.32) PDE4BPDE3ANPBWR1
SCHEMBL24656780 0.73 PDE4B (0.34) PDE4BPDE3ACA2
SCHEMBL24391816 0.72 NPBWR1 (0.33) NPBWR1
SCHEMBL27444620 0.72 MAPT (0.33) NPBWR1MEN1KMT2ACA1CA2
SCHEMBL13920765 0.71 DRD4 (0.39) MEN1RECQLKMT2AL3MBTL1SLC6A2
SCHEMBL24391799 0.71 CYP11B1 (0.31)

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-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PDE4B 714/4885PDE3A 599/4885PDE5A 754/4885

“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.