SCHEMBL22679979

SCHEMBL22679979

CC1(C)c2ccccc2-c2cc(Nc3ccc4sc5ccc(-c6ccccc6)cc5c4c3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 2/20 0.37
▸ RIPK3 Q9Y572 1/20 0.37
▸ LIMK1 P53667 1/20 0.35
▸ PIM3 Q86V86 2/20 0.34
▸ PDK2 Q15119 6/20 0.34
▸ PTGIR P43119 1/20 0.34
▸ EGFR P00533 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ TGFBR1 P36897 1/20 0.33
▸ MAP3K8 P41279 2/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ HDAC1 Q13547 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ RAF1 P04049 1/20 0.31
▸ BRAF P15056 1/20 0.31
▸ MAPT P10636 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
SCHEMBL19147810 0.94 RIPK2 (0.35) RIPK2RIPK3LIMK1PIM3PDK2
SCHEMBL24969718 0.91 PTGIR (0.41) RIPK2RIPK3LIMK1PIM3PTGIR
SCHEMBL17742402 0.88 PTGIR (0.44) PDK2PTGIRMAPT
SCHEMBL24809299 0.87 PDK2 (0.37) RIPK2RIPK3LIMK1PIM3PDK2
SCHEMBL15714096 0.85 PDK2 (0.38) RIPK2RIPK3PIM3PDK2PTGIR
SCHEMBL14681512 0.85 PDK2 (0.44) PDK2MAPT
SCHEMBL24055888 0.85 PDK2 (0.44) PDK2MAPT
SCHEMBL30266582 0.85 PDK2 (0.44) PDK2MAPT
SCHEMBL21446536 0.83 PTGIR (0.37) PDK2PTGIRMAPT
SCHEMBL17550923 0.82 PTGIR (0.38) RIPK2RIPK3LIMK1PIM3PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11637248-B2 Organic electric element comprising compound for organic electric element and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-04-25 — — US disclosed
US-20200365815-A1 ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2020-11-19 — — US disclosed
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