SCHEMBL24969765

SCHEMBL24969765

CC1(C)c2ccccc2-c2ccc(Nc3ccc4sc5cccc(-c6ccccc6)c5c4c3)cc21

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.37
▸ F9 P00740 1/20 0.35
▸ SLC9A1 P19634 2/20 0.33
▸ LIMK1 P53667 1/20 0.33
▸ CHEK1 O14757 1/20 0.33
▸ WEE1 P30291 1/20 0.33
▸ PTGIR P43119 1/20 0.32

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
SCHEMBL24969754 0.93 SLC9A1 (0.34) PDK2F9SLC9A1LIMK1CHEK1
SCHEMBL17690164 0.90 PDK2 (0.38) PDK2F9PTGIR
SCHEMBL23372605 0.89 PDK2 (0.36) PDK2F9SLC9A1
SCHEMBL25002056 0.89 PDK2 (0.36) PDK2F9SLC9A1
SCHEMBL23372570 0.89 PDK2 (0.37) PDK2F9PTGIR
SCHEMBL23372700 0.86 F9 (0.32) PDK2F9SLC9A1LIMK1
SCHEMBL23372499 0.86 F9 (0.33) PDK2F9SLC9A1
SCHEMBL26634579 0.86 LIMK1 (0.42) F9SLC9A1LIMK1CHEK1WEE1
SCHEMBL23372697 0.86 F9 (0.32) PDK2F9SLC9A1LIMK1
SCHEMBL15138615 0.85 PTGIR (0.44) PDK2PTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 — — WO disclosed
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