SCHEMBL21365477

SCHEMBL21365477

CC1(C)c2ccccc2-c2cc(-c3ccc4c5ccc(-c6ccc7c(c6)-c6ccccc6C7(C)C)cc5n(-c5ccc(-c6ccccc6)cc5)c4c3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.36
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ PGR P06401 5/20 0.34
▸ ATM Q13315 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ MAOB P27338 1/20 0.33
▸ AVPR1A P37288 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ APAF1 O14727 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ PTBP1 P26599 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 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
SCHEMBL21365750 0.96 L3MBTL1 (0.41) PDK2RXRARXRBPGRATM
SCHEMBL16904428 0.96 L3MBTL1 (0.41) PDK2RXRARXRBPGRATM
SCHEMBL17736979 0.94 KDM4E (0.39) PDK2RXRARXRBPGRATM
SCHEMBL14960775 0.92 PDK2 (0.35) PDK2RXRARXRBPGRATM
SCHEMBL15159171 0.92 PDK2 (0.35) PDK2RXRARXRBPGRATM
SCHEMBL16904426 0.91 L3MBTL1 (0.46) PDK2RXRARXRBPGRATM
SCHEMBL17562290 0.90 KDM4E (0.36) RXRARXRBATML3MBTL1KDM4E
SCHEMBL14733789 0.90 L3MBTL1 (0.43) PDK2RXRARXRBPGRATM
SCHEMBL21365752 0.90 KDM4E (0.35) PDK2RXRARXRBATML3MBTL1
SCHEMBL17110008 0.90 KDM4E (0.38) PDK2RXRARXRBPGRATM

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
Send feedback