SCHEMBL25586445

SCHEMBL25586445

Clc1nc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-c2cccc3oc4c(-c5cccc6c5sc5c(-c7ccccc7)cccc56)cccc4c23)n1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ PIM2 Q9P1W9 1/20 0.31
▸ PRKDC P78527 2/20 0.31
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CB P42338 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
SCHEMBL25586448 0.91 ALOX5 (0.36) LIMK1ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL25584930 0.90 LIMK1 (0.37) LIMK1ALOX5PIM1CSNK2A2CSNK2B
SCHEMBL25132196 0.89 PIM1 (0.38) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL25458968 0.87 LIMK1 (0.38) LIMK1ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL25586257 0.85 ALOX5 (0.41) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22247900 0.85 ALDH1A1 (0.38) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL24239116 0.85 CYP1A1 (0.32) ALOX5
SCHEMBL19039314 0.84 LIMK1 (0.37) LIMK1ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL23820595 0.83 CYP1A1 (0.37) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21659070 0.83 ALOX5 (0.42) LIMK1ALOX5PIM1CSNK2A2CSNK2B

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-2023099430-A1 TRIPHENYLENE-TRIAZINE-DIBENZOFURAN/DIBENZOTHIOPHENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-08 — — WO disclosed
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