SCHEMBL22330006

SCHEMBL22330006

OB(O)c1ccc2sc3cc(Cl)ccc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ BCKDK O14874 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ TTR P02766 1/20 0.36
▸ CYP2A6 P11509 3/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ PIM2 Q9P1W9 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ IDO1 P14902 2/20 0.34
▸ CHRNA7 P36544 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TDO2 P48775 1/20 0.33
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL22700705 0.95 ENPP2 (0.45) ENPP2KDM4EBCKDKMCL1RXFP1
SCHEMBL30408508 0.84 CA2 (0.41) ENPP2KDM4ETTRALDH1A1
SCHEMBL1792101 0.84 CA2 (0.41) ENPP2KDM4ETTRALDH1A1
SCHEMBL31818 0.79 GPR3 (0.54) ENPP2KDM4ERAB9AMAPTALDH1A1
SCHEMBL22375225 0.78 BCKDK (0.50) KDM4EBCKDKMCL1RXFP1CYP2A6
SCHEMBL4922527 0.78 BCKDK (0.53) KDM4EBCKDKMCL1RXFP1CYP2A6
SCHEMBL31228783 0.78 BCKDK (0.53) KDM4EBCKDKMCL1RXFP1CYP2A6
SCHEMBL3258493 0.78 KDM4E (0.61) KDM4ECYP2A6ROCK1PIM1PIM2
SCHEMBL24343656 0.77 KDM4E (0.46) KDM4EBCKDKMCL1RXFP1CYP2A6
SCHEMBL24343672 0.77 BCKDK (0.45) KDM4EBCKDKMCL1RXFP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023185039-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC APPARATUS COMPRISING SAME 陕西莱特光电材料股份有限公司 2023-10-05 — — WO disclosed
US-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 — — US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 — — US disclosed
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