SCHEMBL26626401

SCHEMBL26626401

CC1(C)c2cc(C#N)ccc2-c2ccc(-c3ccc(Cl)nc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 4/20 0.41
▸ PGR P06401 3/20 0.39
▸ AR P10275 1/20 0.38
▸ PDK2 Q15119 3/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PIK3CD O00329 1/20 0.36
▸ CYP11B2 P19099 3/20 0.35
▸ CYP11B1 P15538 2/20 0.35
▸ CYP17A1 P05093 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ SRPK2 P78362 1/20 0.34
▸ SRPK1 Q96SB4 1/20 0.34
▸ KDM1A O60341 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ BACE2 Q9Y5Z0 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
SCHEMBL30601335 1.00 ALK (0.41) ALKPGRARPDK2MEN1
SCHEMBL15763534 0.82 PGR (0.46) ALKPGRPDK2
SCHEMBL26506713 0.81 PDK2 (0.51) ALKPGRPDK2
SCHEMBL26626403 0.81 CYP2A6 (0.41) PDK2MEN1KMT2APIK3CDCYP2A6
SCHEMBL30601331 0.81 CYP2A6 (0.41) PDK2MEN1KMT2APIK3CDCYP2A6
SCHEMBL25757472 0.79 PGR (0.48) ALKPGRARPDK2
SCHEMBL30709019 0.78 PGR (0.49) PGRARPDK2
SCHEMBL15763532 0.78 PGR (0.49) PGRARPDK2
SCHEMBL14261879 0.78 ALK (0.46) ALKPGRPDK2SRPK2SRPK1
SCHEMBL30601292 0.78 ALK (0.38) ALKPGRPDK2CYP11B2CYP11B1

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
WO-2023211213-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2023-11-02 — — WO disclosed
WO-2023211213-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2023-11-02 — — WO disclosed
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