SCHEMBL21365533

SCHEMBL21365533

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4cccc5c4sc4ccccc45)cc3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
MAPT P10636 1/20 0.32
PRKDC P78527 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HDAC4 P56524 1/20 0.31
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
RXRA P19793 1/20 0.30
PTGER4 P35408 1/20 0.30

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
SCHEMBL21671081 0.97 ALOX5 (0.36) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL12088968 0.94 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL12088670 0.94 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL24914618 0.93 KDM4E (0.35) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL25775373 0.92 L3MBTL1 (0.41) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL20988531 0.91 TNKS (0.36) ALOX5ATML3MBTL1TNKSTNKS2
SCHEMBL21365785 0.90 KDM4E (0.32) ALOX5KDM4EATML3MBTL1PTGER4
SCHEMBL24915246 0.90 KDM4E (0.33) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL24914643 0.89 KDM4E (0.35) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL21347440 0.89 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3767698-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-25 EP disclosed
US-11374178-B2 Organic electroluminescent element NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2022-06-28 US disclosed
US-20210119144-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-04-22 US disclosed
EP-3767698-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2021-01-20 EP disclosed
EP-3605634-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2020-02-05 EP disclosed
WO-2019176605-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2019-09-19 WO disclosed