SCHEMBL27697140

SCHEMBL27697140

COC(=O)C=Cn1ccnc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 5/20 0.44
HCAR2 Q8TDS4 2/20 0.41
KEAP1 Q14145 1/20 0.41
HTT P42858 3/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
KMT2A Q03164 4/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 2/20 0.33
TBXAS1 P24557 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL27461168 0.81 XPO1 (0.38) NFE2L2TBXAS1CYP26A1
SCHEMBL12130354 0.81 HCAR2 (0.42) HCAR2HTTKDM4ELMNAKMT2A
SCHEMBL12130352 0.81 HCAR2 (0.42) HCAR2HTTKDM4ELMNAKMT2A
SCHEMBL6343791 0.77 TBXAS1 (0.44) LMNAKMT2AMEN1TBXAS1ALDH1A1
SCHEMBL7827324 0.77 TBXAS1 (0.44) LMNAKMT2AMEN1TBXAS1ALDH1A1
Acrylic Acid Methyl Ester SCHEMBL28309946 0.76 HTT (0.36) NFE2L2HCAR2KEAP1HTTLMNA
SCHEMBL28774624 0.76 TBXAS1 (0.36) LMNAKMT2AMEN1TBXAS1ALDH1A1
SCHEMBL28300974 0.76 TBXAS1 (0.36) LMNAKMT2AMEN1TBXAS1ALDH1A1
SCHEMBL3947319 0.75 HTT (0.34) HTTKDM4ETBXAS1ALDH1A1MAPK1
SCHEMBL30154067 0.71 TBXAS1 (0.54) KDM4ETBXAS1ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12421631-B2 Additive for thermal production and reinforcement of carbon fiber, and carbon fiber prepared there from KOREA INSTITUTE OF CARBON CONVERGENCE TECHNOLOGY (KR) 2025-09-23 US claimed
CN-102382031-A 3 - substituted allylic ester oxindole and preparation method thereof HEBEI BRANT PHARMACEUTICAL CO LTD 2012-03-21 CN claimed
US-12421631-B2 Additive for thermal production and reinforcement of carbon fiber, and carbon fiber prepared there from KOREA INSTITUTE OF CARBON CONVERGENCE TECHNOLOGY (KR) 2025-09-23 US disclosed
CN-102382031-A 3 - substituted allylic ester oxindole and preparation method thereof HEBEI BRANT PHARMACEUTICAL CO LTD 2012-03-21 CN disclosed
CN-102382031-A 3 - substituted allylic ester oxindole and preparation method thereof HEBEI BRANT PHARMACEUTICAL CO LTD 2012-03-21 CN disclosed
CN-101018816-A Method for producing polymer particles of selected size, shape, morphology and composition KUMACHEVA EUGENIA (CA) 2007-08-15 CN disclosed