SCHEMBL28080833

SCHEMBL28080833

Cc1ccc(C2=C(c3ccc(C)cc3)C(=O)NC2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.69
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
CYP2C19 P33261 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ALDH1A1 P00352 1/20 0.47
EGFR P00533 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
LMNA P02545 1/20 0.41
GSK3B P49841 2/20 0.40
ACHE P22303 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL3815134 0.91 PTGS2 (0.65) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL1164429 0.89 PTGS2 (0.58) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL28319115 0.85 CYP2D6 (0.59) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL815442 0.81 PTGS2 (0.50) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL3819171 0.80 GSK3B (0.51) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL7193397 0.80 PTGS2 (0.48) PTGS2GSK3B
SCHEMBL12722603 0.78 PTGS2 (0.47) PTGS2CYP2D6CYP2C9HPGDALOX15
SCHEMBL27936511 0.77 PTGS2 (0.48) PTGS2GSK3B
SCHEMBL7778524 0.76 GSK3B (0.78) GSK3B
SCHEMBL27950468 0.75 PTGS2 (0.69) PTGS2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120192721-A Die attach film and semiconductor package including the same 三星电子株式会社 2025-06-24 CN disclosed
CN-103804108-B A kind of method preparing primary amine 沈阳药科大学 2016-08-03 CN disclosed