SCHEMBL25624097

SCHEMBL25624097

CC(C)(C)[Si](C)(C)OCCOc1cc(COC2CCCCO2)cnn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ICAM1 P05362 1/20 0.33
▸ SELE P16581 1/20 0.33
▸ CREBBP Q92793 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ DHFR P00374 1/20 0.32
▸ GRM5 P41594 1/20 0.30
▸ EP300 Q09472 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
SCHEMBL25624204 0.85 KDM4C (0.39) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL25624099 0.84 KDM4C (0.41) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL25219615 0.82 KDM4C (0.40) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL19223858 0.80 KDM4C (0.44) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL31052348 0.77 KDM4C (0.47) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL25221157 0.75 DUT (0.31) —
SCHEMBL30542325 0.73 NPC1 (0.45) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL25273570 0.73 NPC1 (0.45) KDM4CNPC1RAB9AL3MBTL1ICAM1
SCHEMBL16401219 0.73 KDM4C (0.46) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL1054538 0.73 L3MBTL1 (0.37) KDM4CNPC1RAB9AL3MBTL1MEN1

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-2023103898-A1 COMPOUND HAVING CLK AND DYRK INHIBITORY ACTIVITIES, PREPARATION METHOD THEREFOR AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-06-15 — — WO disclosed
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