SCHEMBL25527223

SCHEMBL25527223

Cn1nc(C(C)(C)C)c2cc(F)cnc21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.38
SPR P35270 2/20 0.35
POLB P06746 1/20 0.32
CYP1A2 P05177 1/20 0.32
HTR3A P46098 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PDE10A Q9Y233 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
SSTR4 P31391 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
SCHEMBL29324752 0.81 GSK3B (0.39) GSK3BSPRPOLBCYP1A2HCRTR1
SCHEMBL18538049 0.81 ALDH1A1 (0.42) GSK3BPOLBCYP1A2MAPT
SCHEMBL28619610 0.80 HSD17B10 (0.40) GSK3BSPRPOLBHCRTR1HCRTR2
SCHEMBL18538040 0.80 HPGD (0.40) GSK3BSPRPOLBL3MBTL1HCRTR1
SCHEMBL16167735 0.77 SPR (0.52) GSK3BSPRPOLBCYP1A2PDE10A
SCHEMBL19480629 0.76 GSK3B (0.58) GSK3BSPRPOLBHTR3APDE10A
SCHEMBL19230910 0.76 SPR (0.36) GSK3BSPRPOLBHTR3APDE10A
SCHEMBL25091051 0.75 HCRTR1 (0.33) CYP1A2HCRTR1HCRTR2
SCHEMBL29582154 0.72 PI4KA (0.36) GSK3BHCRTR1HCRTR2
SCHEMBL25091063 0.72 HCRTR1 (0.38) GSK3BCYP1A2L3MBTL1PDE10AHCRTR1

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 3 patents. 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
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 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 (2 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 GSK3B 581/4885SPR 3510/4885POLB 492/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP GSK3B 948/4885SPR 4400/4885POLB 2269/4885

“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.