SCHEMBL31751941

SCHEMBL31751941

FC(F)(F)C1(c2ccc(Nc3ccccc3)cc2)N=N1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.50
ALDH1A1 P00352 7/20 0.48
HSD17B10 Q99714 5/20 0.48
TDP1 Q9NUW8 4/20 0.48
ALOX12 P18054 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
TSHR P16473 3/20 0.48
ALOX15 P16050 2/20 0.48
MAPK1 P28482 2/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
PTGS2 P35354 1/20 0.48
HTR2B P41595 1/20 0.48
PDK2 Q15119 1/20 0.43
MAPT P10636 6/20 0.41
CYP3A4 P08684 4/20 0.41
HPGD P15428 3/20 0.41
HTT P42858 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL80368 0.82 KIF11 (0.43) KIF11ALDH1A1TSHRPDK2
SCHEMBL31751780 0.81 KIF11 (0.47) KIF11EPHX2IDH2
SCHEMBL18286628 0.77 KIF11 (0.53) KIF11ALDH1A1HSD17B10TSHRALOX15
SCHEMBL5275595 0.76 MAOB (0.39) KIF11ALDH1A1TSHRPDK2
SCHEMBL30970983 0.73 KIF11 (0.61) KIF11
SCHEMBL20336329 0.73 KIF11 (0.61) KIF11
SCHEMBL17848085 0.71 KIF11 (0.51) KIF11MAPT
SCHEMBL23860299 0.70 KIF11 (0.45) KIF11PDK2KDM4E
SCHEMBL14655026 0.70 KIF11 (0.49) KIF11ALDH1A1TDP1L3MBTL1TSHR
SCHEMBL22587365 0.70 KIF11 (0.45) KIF11KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025262615-A1 ANTIOXIDANTS CONTAINING DIAZIRINE FUNCTIONALITIES, COMPOSITIONS COMPRISING THEM AND USE THEREOF BELLARE ANUJ (US) 2025-12-26 WO disclosed