SCHEMBL20476705

SCHEMBL20476705

Cn1ccc2cnc(Br)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CB P42338 1/20 0.49
CYP2A6 P11509 2/20 0.41
PRKCI P41743 1/20 0.40
MAPT P10636 2/20 0.40
EGFR P00533 2/20 0.37
HSD11B1 P28845 1/20 0.34
LRRK2 Q5S007 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRM4 Q14833 2/20 0.33
PDE10A Q9Y233 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTR2B P41595 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL30202304 0.85 PIK3CB (0.62) PIK3CBCYP2A6PRKCIMAPTEGFR
SCHEMBL7926055 0.78 PIK3CB (0.50) PIK3CBCYP2A6PRKCIMAPTHSD11B1
SCHEMBL18230343 0.77 CDC7 (0.49) PIK3CBCYP2A6PRKCIMAPTHSD11B1
SCHEMBL21281591 0.77 PIK3CB (0.49) PIK3CBCYP2A6PRKCIMAPTEGFR
SCHEMBL31435644 0.77 CDC7 (0.49) PIK3CBCYP2A6PRKCIMAPTHSD11B1
SCHEMBL23346741 0.77 PIK3CB (0.73) PIK3CBCYP2A6PRKCIMAPTEGFR
SCHEMBL15741962 0.77 JAK2 (0.40) PIK3CBEGFRHTR2C
SCHEMBL21052271 0.75 CDK4 (0.35) EGFRHTR2C
SCHEMBL21281472 0.74 PIK3CB (0.46) PIK3CBCYP2A6PRKCIMAPTHSD11B1
SCHEMBL20276284 0.74 PIK3CB (0.46) PIK3CBCYP2A6PRKCIMAPTEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4217062-B1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-10-09 EP disclosed
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-06-27 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
US-20220089538-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-03-24 US disclosed
WO-2018149986-A1 2-(BICYCLO-HETEROARYL)-ISONICOTINIC DERIVATIVES AS HISTONE DEMETHYLASE INHIBITORS ORYZON GENOMICS, S.A. (ES) 2018-08-23 WO 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 (3 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-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP PIK3CB 1249/4885CYP2A6 977/4885PRKCI 1932/4885
US-20220089538-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP PIK3CB 1244/4885CYP2A6 976/4885PRKCI 1948/4885
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators MGLL, LPL, PNLIP PIK3CB 1244/4885CYP2A6 976/4885PRKCI 1948/4885

“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.