SCHEMBL3012126

SCHEMBL3012126

O=C(C=Cc1ccccc1)c1c[nH]nn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 8/20 0.56
MAPT P10636 7/20 0.56
MAOB P27338 5/20 0.56
LMNA P02545 3/20 0.56
BCHE P06276 3/20 0.56
PLIN1 O60240 2/20 0.56
RECQL P46063 2/20 0.56
PLIN5 Q00G26 2/20 0.56
ABHD5 Q8WTS1 2/20 0.56
TNFRSF1A P19438 2/20 0.56
ACHE P22303 1/20 0.56
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
PKM P14618 2/20 0.55
KDM4E B2RXH2 1/20 0.55
CYP3A4 P08684 4/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP1A1 P04798 1/20 0.49
F3 P13726 2/20 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
SCHEMBL3012123 1.00 CYP1B1 (0.56) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL3011502 0.80 MAOB (0.58) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL3011508 0.80 MAOB (0.58) CYP1B1MAPTMAOBLMNABCHE
Chalcone SCHEMBL28915601 0.77 CYP1B1 (0.55) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL10800121 0.75 MAPT (0.58) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL10800126 0.75 MAPT (0.58) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL11767544 0.74 AKR1C1 (0.51) MAPTLMNAKDM4ECYP3A4CYP1A2
SCHEMBL10790252 0.74 KMT2A (0.46) MAPTLMNARECQLRAB9ANPC1
Fluoride SCHEMBL28262071 0.74 MAPT (0.56) CYP1B1MAPTMAOBLMNABCHE
SCHEMBL10503149 0.74 NFE2L2 (0.46) CYP1B1MAPTMAOBLMNABCHE

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240216-B1 PROCESS FOR PREPARING E-ISOMER OF TRIAZOLYL STYRYL KETONE DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-21 EP claimed
EP-0233005-B1 PROCESS FOR PREPARING E-ISOMER OF A TRIAZOLYL STYRYL KETONE DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-03-18 EP claimed
US-4814461-A ISOMERIZATION OF Z-ISOMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-03-21 US claimed
US-4814460-A ISOMERIZATION OF Z-ISOMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-03-21 US claimed
EP-0240216-A1 Process for preparing E-isomer of triazolyl styryl ketone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP claimed
EP-0233005-A2 Process for preparing E-isomer of a triazolyl styryl ketone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-19 EP claimed
JP-58140081-A None JP disclosed
JP-58146575-A None JP disclosed
JP-58140082-A None JP disclosed
EP-4739672-A1 NEW COMPOUNDS Aston University (GB) 2026-05-13 EP disclosed
EP-4739671-A1 NEW COMPOUNDS Aston University (GB) 2026-05-13 EP disclosed
CN-119930529-A Cinnamoyl triazole compound, preparation method thereof and application thereof in neuroprotection 中国医学科学院医药生物技术研究所 2025-05-06 CN disclosed
CN-119930529-A Cinnamoyl triazole compound, preparation method thereof and application thereof in neuroprotection 中国医学科学院医药生物技术研究所 2025-05-06 CN disclosed
EP-0233005-A2 Process for preparing E-isomer of a triazolyl styryl ketone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-19 EP disclosed
EP-0233005-A2 Process for preparing E-isomer of a triazolyl styryl ketone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-19 EP disclosed
EP-0233005-A2 Process for preparing E-isomer of a triazolyl styryl ketone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-19 EP disclosed
EP-0101996-B1 PROCESS FOR THE PREPARATION OF E-ISOMERS OF 1-CYCLOHEXYL-2-(1,2,4-TRIAZOL-1-YL)-1-PENTEN-3-ON DERIVATIVES BAYER AG (DE) 1986-07-16 EP disclosed
JP-S58146575-A SULFATE SALT OF TRIAZOLYL STYRYL KETONE DERIVATIVE SUMITOMO CHEM CO LTD 1983-09-01 JP disclosed
JP-S58140081-A SEPARATION OF GEOMETRIC ISOMER OF TRIAZOLYL STYRYL KETONE DERIVATIVE SUMITOMO CHEM CO LTD 1983-08-19 JP disclosed
JP-S58140082-A PURIFICATION OF TRIAZOLYL STYRYL KETONE DERIVATIVE SUMITOMO CHEM CO LTD 1983-08-19 JP disclosed