SCHEMBL13898705

SCHEMBL13898705

Cc1c(Br)cccc1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.48
PDK2 Q15119 5/20 0.36
PDK4 Q16654 4/20 0.36
BRD4 O60885 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SLC6A4 P31645 2/20 0.36
KDM1A O60341 1/20 0.35
HTR6 P50406 3/20 0.35
PDK1 Q15118 1/20 0.34
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
HTR2B P41595 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL26327973 0.90 HTR2C (0.44) HTR2CHTR1AHTR7
SCHEMBL22136718 0.77 HTR2C (0.50) HTR2C
SCHEMBL16956125 0.77 HTR2C (0.74) HTR2CPDK2PDK4ALDH1A1HTR6
SCHEMBL29427088 0.77 KDM1A (0.50) HTR2CBRD4ALDH1A1SLC6A4KDM1A
SCHEMBL10046437 0.77 KDM1A (0.50) HTR2CBRD4ALDH1A1SLC6A4KDM1A
SCHEMBL31192260 0.75 HTR2C (0.40) HTR2CHTR6
SCHEMBL2049314 0.75 HTR2C (0.34) HTR2CALDH1A1
SCHEMBL2045827 0.74 HTR2C (0.48) HTR2CPDK2PDK4HTR6PDK1
SCHEMBL3968766 0.74 KDM1A (0.35) HTR2CPDK2PDK4BRD4SLC6A4
SCHEMBL16953486 0.74 HTR2C (0.48) HTR2CPDK2PDK4ALDH1A1SLC6A4

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 13 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-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-06-27 US 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-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
EP-4217062-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 EP disclosed
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed
WO-2022063784-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-03-31 WO disclosed
US-20220089538-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-03-24 US disclosed
EP-2036891-A2 Isoquinoline inhibitors of P38 Vertex Pharmaceuticals Incorporated (US) 2009-03-18 EP disclosed
EP-1077943-B1 HETEROCYCLIC INHIBITORS OF P38 VERTEX PHARMA (US) 2008-12-17 EP 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 HTR2C 457/4885PDK2 1657/4885PDK4 988/4885
US-20220089538-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP HTR2C 438/4885PDK2 1639/4885PDK4 994/4885
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators MGLL, LPL, PNLIP HTR2C 438/4885PDK2 1639/4885PDK4 994/4885

“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.