SCHEMBL14534162

SCHEMBL14534162

Bc1cccc2c(CO)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
CYP2A6 P11509 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
ACP3 P15309 1/20 0.32
CYP2C19 P33261 2/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL3034972 0.87 APOBEC3G (0.48) KDM4ELMNATSHRTP53MAPT
SCHEMBL29602462 0.87 APOBEC3G (0.48) KDM4ELMNATSHRTP53MAPT
SCHEMBL12319786 0.79
SCHEMBL12807505 0.78 CYP1A2 (0.39) KDM4ETSHRMAPTCYP2A6SMN1; SMN2
SCHEMBL23513636 0.76 PDCD1 (0.53) APOBEC3GPDCD1CD274CYP2C19GABRA1
SCHEMBL24801293 0.76 APOBEC3G (0.37) LMNAAPOBEC3GPDCD1CD274GABRA1
SCHEMBL12667816 0.76 APOBEC3G (0.37) APOBEC3GPDCD1CD274GABRA1GABRB2
SCHEMBL431656 0.75 CYP2A6 (0.48) KDM4ELMNATSHRTP53MAPT
SCHEMBL29602459 0.75 CYP2A6 (0.48) KDM4ELMNATSHRTP53MAPT
SCHEMBL2987022 0.75 LMNA (0.53) KDM4ELMNATSHRTP53MAPT

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-2007058503-A1 EMITTING MATERIAL AND ORGANIC LIGHT EMITTING DIODE USING THE SAME LG CHEM. LTD. (KR) 2007-05-24 WO disclosed