SCHEMBL25539251

SCHEMBL25539251

Cc1nc2c(F)cc(F)cn2c1C

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34
CYP3A4 P08684 10/20 0.33
CYP2C9 P11712 10/20 0.33
CYP11B2 P19099 2/20 0.32
CYP11B1 P15538 1/20 0.32
PDE10A Q9Y233 2/20 0.32
ATP4A P20648 2/20 0.31
ATP4B P51164 2/20 0.31
CYP2D6 P10635 4/20 0.30
CYP2C19 P33261 4/20 0.30
CYP1A2 P05177 2/20 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
SCHEMBL24656096 0.85 CYP3A4 (0.33) CYP3A4CYP2C9CYP11B2CYP11B1PDE10A
SCHEMBL25104683 0.85 ATP4A (0.34) CYP3A4CYP2C9ATP4AATP4BCYP2D6
SCHEMBL7498143 0.81 CYP3A4 (0.34) CYP3A4CYP2C9CYP11B2CYP11B1PDE10A
SCHEMBL16739601 0.81 AKT1 (0.33) AKT1AKT2
SCHEMBL25104409 0.81 CYP3A4 (0.30) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL25103350 0.81 NMT1 (0.33) CYP3A4CYP2C9
SCHEMBL24654970 0.79 AKT1 (0.32) AKT1AKT2
SCHEMBL21893930 0.76 F11 (0.35) AKT1AKT2
SCHEMBL25311595 0.75 MAPT (0.38) CYP2C9CYP2C19CYP1A2
Potassium Ion SCHEMBL21819369 0.74 HTR2A (0.32)

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-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 (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-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP AKT1 2136/4885AKT2 2424/4885CYP3A4 1414/4885

“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.