SCHEMBL23891645

SCHEMBL23891645

C=C(CCCCCC)c1ccc(C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 12/20 0.41
▸ PLK3 Q9H4B4 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ RARB P10826 1/20 0.38
▸ THRA P10827 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL9501895 0.85 HTT (0.46) PLK1PLK3L3MBTL1GAATDP1
SCHEMBL23891675 0.84 GAA (0.41) GAARARBTHRATHRBHTT
SCHEMBL2010661 0.79 L3MBTL1 (0.49) L3MBTL1GAATDP1THRATHRB
SCHEMBL28382016 0.78 HTT (0.57) L3MBTL1GAATDP1THRATHRB
SCHEMBL29175153 0.77 MAOA (0.50) L3MBTL1TDP1HTT
SCHEMBL19042193 0.77 L3MBTL1 (0.46) L3MBTL1TDP1THRATHRBHTT
SCHEMBL23891581 0.77 HTR7 (0.45) GAARARB
SCHEMBL23891535 0.76 TAS1R3 (0.35) TDP1HTT
Heptane SCHEMBL11441128 0.76 RARB (0.61) PLK1PLK3RARB
SCHEMBL4451530 0.75 THRA (0.45) PLK1PLK3L3MBTL1GAATDP1

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
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 — — EP disclosed
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