SCHEMBL27167232

SCHEMBL27167232

COc1ccc(C(=O)C#Cc2ccc(C)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.75
VCP P55072 1/20 0.66
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 1/20 0.50
ACHE P22303 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47

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
SCHEMBL28695966 1.00 APP (0.75) APPVCPMAOAMAOBNPC1
SCHEMBL10069794 0.93 APP (0.84) APPVCPNPC1RAB9ACES2
SCHEMBL25749196 0.88 VCP (0.82) APPVCPCES2CES1
SCHEMBL29869041 0.87 APP (0.58) APPVCPMAOAMAOBNPC1
SCHEMBL21679451 0.87 APP (0.58) APPVCPMAOAMAOBNPC1
SCHEMBL28972914 0.86 APP (0.73) APPVCPRAB9ACES2CES1
SCHEMBL28972932 0.86 APP (0.64) APPVCPNPC1RAB9ACES2
SCHEMBL28629549 0.86 APP (0.73) APPVCPCES2CES1
SCHEMBL28972824 0.86 APP (0.73) APPVCPMAOAMAOBNPC1
SCHEMBL10170737 0.86 APP (0.73) APPVCPCES2CES1

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
US-20250186408-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2025-06-12 US disclosed
EP-4333819-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY Katholieke Universiteit Leuven (BE) 2024-03-13 EP disclosed
WO-2022233877-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-11-10 WO disclosed
CN-113429280-B Method for preparing chalcone compounds by selective hydrogenation reduction of alkynone under catalysis of Ti (III) complex 陕西师范大学 2022-08-23 CN disclosed
CN-113429280-A Method for preparing chalcone compounds by selective hydrogenation reduction of alkynone under catalysis of Ti (III) complex 陕西师范大学 2021-09-24 CN 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-20250186408-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY CNR1, CNR2, CYP2J2 APP 1233/4885VCP 4323/4885MAOA 2962/4885

“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.