SCHEMBL29437756

SCHEMBL29437756

O=C1c2ccccc2CCc2ccccc21

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.90
MAOA P21397 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.67
TDP1 Q9NUW8 1/20 0.67
MAOB P27338 3/20 0.59
BCHE P06276 1/20 0.58
MEN1 O00255 1/20 0.58
CDC25B P30305 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP2A6 P11509 1/20 0.56
MAPK14 Q16539 2/20 0.53
AKR1B1 P15121 1/20 0.53
PDPK1 O15530 1/20 0.52
PARP1 P09874 1/20 0.52
PARP10 Q53GL7 1/20 0.52
PARP11 Q9NR21 1/20 0.52
MIF P14174 6/20 0.52
CYP19A1 P11511 2/20 0.52
PKM P14618 1/20 0.52
CYP11B2 P19099 1/20 0.52

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
SCHEMBL29408351 1.00 CES1 (0.90) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL44496 1.00 CES1 (0.90) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL13712393 0.94 CES1 (1.00) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL11144928 0.90 CES1 (0.73) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL29384891 0.87 CES1 (0.77) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL2231281 0.87 CES1 (0.77) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL1739155 0.84 CES1 (0.71) CES1MAOAL3MBTL1TDP1MAOB
SCHEMBL5508289 0.84 CES1 (0.71) CES1MAOAL3MBTL1TDP1MAOB
Anthrone SCHEMBL18143 0.83 MAOA (1.00) CES1MAOAL3MBTL1TDP1MAOB
Anthrone SCHEMBL29357010 0.83 MAOA (1.00) CES1MAOAL3MBTL1TDP1MAOB

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
EP-4692092-A1 NOVEL COMPOUNDS WITH MTORC2-INHIBITORY ACTIVITY AND USES THEREOF Aliad Biopharma (KR) 2026-02-11 EP disclosed
CN-120025250-A Synthesis method of cyclobenzaprine hydrochloride 山东新时代药业有限公司 2025-05-23 CN disclosed
WO-2025104433-A1 CATALYST AND SYNTHESIS THEREOF UNIVERSITY OF STRATHCLYDE (GB) 2025-05-22 WO disclosed
WO-2024205377-A1 NOVEL COMPOUNDS WITH MTORC2-INHIBITORY ACTIVITY AND USES THEREOF 알리아드바이오파마 주식회사 2024-10-03 WO disclosed
EP-4159212-A1 P38 KINASE INHIBITORS REDUCE DUX4 AND DOWNSTREAM GENE EXPRESSION FOR THE TREATMENT OF FSHD Fulcrum Therapeutics, Inc. (US) 2023-04-05 EP disclosed
US-20220282254-A1 P38 KINASE INHIBITORS REDUCE DUX4 AND DOWNSTREAM GENE EXPRESSION FOR THE TREATMENT OF FSHD FULCRUM THERAPEUTICS INC (US) 2022-09-08 US disclosed
US-20220133704-A1 P38 KINASE INHIBITORS REDUCE DUX4 AND DOWNSTREAM GENE EXPRESSION FOR THE TREATMENT OF FSHD FULCRUM THERAPEUTICS INC (US) 2022-05-05 US disclosed
US-11291659-B2 P38 kinase inhibitors reduce DUX4 and downstream gene expression for the treatment of FSHD Fulcrum Therapeutics, Inc. (US) 2022-04-05 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 (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-20220133704-A1 P38 KINASE INHIBITORS REDUCE DUX4 AND DOWNSTREAM GENE EXPRESSION FOR THE TREATMENT OF FSHD ZFX, TBL1XR1, TRIM28 CES1 4476/4885MAOA 3791/4885L3MBTL1 421/4885
US-20220282254-A1 P38 KINASE INHIBITORS REDUCE DUX4 AND DOWNSTREAM GENE EXPRESSION FOR THE TREATMENT OF FSHD ZFX, TBL1XR1, TRIM28 CES1 4476/4885MAOA 3791/4885L3MBTL1 421/4885
US-11291659-B2 P38 kinase inhibitors reduce DUX4 and downstream gene expression for the treatment of FSHD ZFX, TBL1XR1, TRIM28 CES1 4476/4885MAOA 3791/4885L3MBTL1 421/4885

“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.