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SCHEMBL26569096

SCHEMBL26569096

c1ccc(-c2ccc(-c3ccc(N(c4ccccc4-c4cccc5cccc(-c6ccccc6)c45)c4ccccc4-c4cccc5sc6ccccc6c45)cc3)cc2-c2ccccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ SLC9A1 P19634 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ BRDT Q58F21 1/20 0.31
▸ SLC6A9 P48067 1/20 0.31
▸ HSD17B1 P14061 1/20 0.30
▸ HSD17B2 P37059 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
SCHEMBL26569103 0.98 F9 (0.31) F9PTPN1SLC9A1CA12CA1
SCHEMBL26569100 0.97 PTPN1 (0.31) F9PTPN1SLC9A1CA12CA1
SCHEMBL26569288 0.95 F9 (0.32) F9PTPN1SLC9A1CA12CA1
SCHEMBL26569089 0.94 — —
SCHEMBL26569442 0.92 LIMK1 (0.32) F9SLC9A1BRDT
SCHEMBL26588558 0.92 ALDH1A1 (0.33) F9SLC9A1BRDT
SCHEMBL26585219 0.92 ALDH1A1 (0.33) F9SLC9A1BRDT
SCHEMBL26588515 0.92 S1PR5 (0.35) F9SLC9A1CA12CA1CA2
SCHEMBL26569724 0.91 LIMK1 (0.33) F9PTPN1SLC9A1BRDT
SCHEMBL26568547 0.91 LIMK1 (0.33) F9PTPN1SLC9A1BRDT

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-2023182323-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-28 — — WO disclosed