SCHEMBL29935585

SCHEMBL29935585

Cc1cnc2c(C=O)cnn2c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 12/20 0.40
HSD11B1 P28845 3/20 0.36
KDR P35968 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PDE10A Q9Y233 2/20 0.33
PDE3A Q14432 1/20 0.33
RAB9A P51151 1/20 0.32
DUSP3 P51452 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGS2 P35354 1/20 0.32
CSNK2B P67870 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
SCHEMBL29291264 0.82 PDE2A (0.37) PDE2AHSD11B1KDRPDE10APDE3A
SCHEMBL30828011 0.79 KDR (0.34) PDE2AKDRCSNK2B
SCHEMBL18397071 0.79 MAPT (0.35) KDRALDH1A1SMN1; SMN2PTGS2CSNK2B
SCHEMBL15308505 0.75 PDE2A (0.41) PDE2AHSD11B1KDRPDE10APDE3A
SCHEMBL15344923 0.73 PDE2A (0.44) PDE2AHSD11B1KDRPDE10APDE3A
SCHEMBL16628978 0.72 PDE2A (0.40) PDE2AHSD11B1KDRPDE10APDE3A
SCHEMBL21893829 0.72 SMPD3 (0.48) PDE2AHSD11B1KDR
SCHEMBL12517707 0.72 PRKAB2 (0.51) PDE2AHSD11B1KDRALDH1A1PDE10A
SCHEMBL31595688 0.71 EPHB3 (0.41) ALDH1A1LMNARAB9ADUSP3SMN1; SMN2
Hydrochloric Acid SCHEMBL22835004 0.70 SMPD3 (0.47) PDE2AHSD11B1KDR

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 CN claimed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN claimed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 CN disclosed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
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 (4 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 PDE2A 360/4885HSD11B1 286/4885KDR 2013/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH PDE2A 793/4885HSD11B1 86/4885KDR 3121/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PDE2A 360/4885HSD11B1 286/4885KDR 2013/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP PDE2A 360/4885HSD11B1 286/4885KDR 2013/4885

“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.