SCHEMBL29466836

SCHEMBL29466836

Cc1cc(C(F)(F)F)ccc1-n1c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)ccc2c2ccc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)cc21

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.45
▸ MAT2A P31153 2/20 0.38
▸ PPARG P37231 4/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PLA2G10 O15496 1/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ GSR P00390 2/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ NOTUM Q6P988 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CYP2C9 P11712 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ SCN9A Q15858 2/20 0.34
▸ CYP2D6 P10635 1/20 0.34

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
SCHEMBL10090575 0.86 KIF11 (0.55) KIF11MAT2APPARGKDM4EATM
SCHEMBL10090551 0.84 KIF11 (0.51) KIF11MAT2APPARGKDM4EATM
SCHEMBL18360986 0.83 KIF11 (0.57) KIF11MAT2APPARGKDM4EATM
SCHEMBL10090550 0.79 KIF11 (0.47) KIF11MAT2APPARGKDM4EATM
SCHEMBL21032832 0.79 ATM (0.44) KDM4EATML3MBTL1ALDH1A1
SCHEMBL20364454 0.79 KIF11 (0.46) KIF11MAT2AALDH1A1
SCHEMBL16901041 0.77 ATM (0.57) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL17425606 0.77 ATM (0.57) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL30022823 0.77 ATM (0.57) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL19238811 0.77 L3MBTL1 (0.62) KDM4EATML3MBTL1ALDH1A1LMNA

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
CN-114249686-A Carbazole-containing near-ultraviolet light/ultraviolet light organic semiconductor material, preparation method thereof and application thereof in OLED 华南理工大学 2022-03-29 — — CN disclosed
Send feedback