SCHEMBL21365564

SCHEMBL21365564

c1ccc(-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6c7sc8ccccc8c7ccc65)n4)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ALOX5 P09917 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
MAPT P10636 1/20 0.32
LIMK1 P53667 2/20 0.30
GPR3 P46089 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
SCHEMBL16521269 1.00 TNKS (0.32) TNKSTNKS2ALOX5MEN1KMT2A
SCHEMBL15625613 1.00 TNKS (0.32) TNKSTNKS2ALOX5MEN1KMT2A
SCHEMBL14979382 0.98 TNKS (0.33) TNKSTNKS2ALOX5MEN1KMT2A
SCHEMBL19474356 0.96 ALOX5 (0.34) TNKSTNKS2ALOX5MAPTLIMK1
SCHEMBL16297509 0.95 TNKS (0.32) TNKSTNKS2MEN1KMT2AMAPT
SCHEMBL16437629 0.95 TNKS (0.32) TNKSTNKS2MAPTGPR3
SCHEMBL18566533 0.95 TNKS (0.33) TNKSTNKS2ALOX5MEN1KMT2A
SCHEMBL16978563 0.94 ALOX5 (0.34) TNKSTNKS2ALOX5MAPTLIMK1
SCHEMBL19997870 0.94 ALOX5 (0.34) TNKSTNKS2ALOX5MAPTLIMK1
SCHEMBL16521300 0.94 TNKS (0.34) TNKSTNKS2ALOX5MEN1KMT2A

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 4 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-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
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