SCHEMBL22136576

SCHEMBL22136576

c1ccc(-c2ccc(-c3ccc(N(c4ccc5c6ccccc6c6ccccc6c5c4)c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.35
▸ LIMK1 P53667 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ PTPN1 P18031 1/20 0.31
▸ SLC9A1 P19634 1/20 0.30
▸ BRDT Q58F21 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
SCHEMBL22435903 0.93 LIMK1 (0.36) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435908 0.92 F9 (0.36) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435894 0.91 F9 (0.35) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL15179758 0.91 F9 (0.39) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435896 0.90 LIMK1 (0.34) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435912 0.90 LIMK1 (0.34) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435897 0.90 PTPN1 (0.35) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22435910 0.90 F9 (0.34) F9LIMK1ALOX5PTPN1SLC9A1
SCHEMBL22136329 0.89 F9 (0.38) F9LIMK1ALOX5SLC9A1
SCHEMBL22435905 0.89 F9 (0.34) F9LIMK1ALOX5PTPN1SLC9A1

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-2020130528-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-06-25 — — WO disclosed
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