SCHEMBL24219953

SCHEMBL24219953

O=S(=O)(c1ccc(F)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 2/20 0.43
GAA P10253 1/20 0.43
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTR6 P50406 3/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH3A1 P30838 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
METAP2 P50579 1/20 0.41
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL12937259 0.91 KDM4E (0.59) KDM4EATML3MBTL1ALDH1A1HTR6
SCHEMBL30785606 0.91 KDM4E (0.59) KDM4EATML3MBTL1ALDH1A1HTR6
SCHEMBL19238790 0.86 KDM4E (0.53) KDM4EATML3MBTL1GAAALDH1A1
SCHEMBL29385 0.86 KDM4E (0.67) KDM4EATML3MBTL1ALDH1A1METAP2
SCHEMBL28522087 0.84 MAPK14 (0.40) KDM4EATML3MBTL1TP53GAA
SCHEMBL16724444 0.83 KDM4E (0.50) KDM4EATML3MBTL1HTR6CA12
SCHEMBL18216928 0.83 KDM4E (0.55) KDM4EATML3MBTL1GAAALDH1A1
SCHEMBL17690734 0.83 L3MBTL1 (0.50) KDM4EATML3MBTL1KEAP1NFE2L2
SCHEMBL16724442 0.83 KDM4E (0.50) KDM4EATML3MBTL1HTR6CA12
SCHEMBL16664371 0.83 KDM4E (0.50) KDM4EATML3MBTL1HTR6CA12

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
EP-4372057-A2 TADF MATERIALS COMPRISING 4-(3-(2-(10H-PHENOXAZIN-10-YL)PYRIDIN-5-YL)-9H-CARBAZOL-9-YL)BENZONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OLEDS Noctiluca S.A. (PL) 2024-05-22 EP disclosed
EP-3943492-A1 TADF MATERIALS COMPRISING 4-(3-(2-(10H-PHENOXAZIN-10-YL)PYRIDIN-5-YL)-9H-CARBAZOL-9-YL)BENZONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OLEDS Noctiluca S.A. (PL) 2022-01-26 EP disclosed