SCHEMBL20172228

SCHEMBL20172228

Nc1ccc2c(c1)oc1cnccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ TDO2 P48775 13/20 0.47
▸ IDO1 P14902 9/20 0.47
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ ROCK2 O75116 2/20 0.42

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
SCHEMBL17490042 0.87 NPC1 (0.59) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL17490209 0.87 KDM4E (0.58) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL15973035 0.82 ROCK2 (0.48) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL11885001 0.82 IDO1 (0.46) TDO2IDO1ROCK2
SCHEMBL1547415 0.82 KDM4E (0.75) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL24055838 0.78 AHR (0.56) TDO2IDO1ROCK2
SCHEMBL21398285 0.78 IDO1 (0.48) KDM4EALDH1A1MAPTKMT2ATDO2
SCHEMBL22373976 0.78 TDO2 (0.50) KDM4EALDH1A1HPGDTDO2IDO1
SCHEMBL20209307 0.78 KDM4E (0.69) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL17490045 0.74 NPC1 (0.56) KDM4EALDH1A1HPGDMEN1MAPT

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
EP-3339395-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2019-10-02 — — EP disclosed
EP-3339395-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2018-06-27 — — EP disclosed
EP-2980182-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2018-05-23 — — EP disclosed
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