SCHEMBL22745273

SCHEMBL22745273

Cc1ccccc1C(=O)c1ccc2c(c1)C(Cc1ccc(C(=O)C(C)(C)N3CCOCC3)cc1)(Cc1ccc(C(=O)C(C)(C)N3CCOCC3)cc1)c1ccccc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KMT2A Q03164 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PDK2 Q15119 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPK13 O15264 1/20 0.33
▸ MAPK12 P53778 1/20 0.33
▸ MAPK11 Q15759 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33

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
SCHEMBL22745167 0.90 TSHR (0.48) ALDH1A1TSHRMAPK1SMN1; SMN2HPGD
SCHEMBL22745277 0.89 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL22745104 0.87 TSHR (0.53) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL22745179 0.85 ALDH1A1 (0.46) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL22745169 0.84 ALDH1A1 (0.53) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL23805888 0.84 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL22745256 0.84 MAPK13 (0.38) ALDH1A1HTTPDK2MAPK13MAPK12
SCHEMBL22745173 0.82 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL23567072 0.82 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A
SCHEMBL22745178 0.82 TSHR (0.34) ALDH1A1TSHRMAPK1SMN1; SMN2KMT2A

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-2020238862-A1 FLUORENE INITIATOR, PHOTOCURABLE COMPOSITION COMPRISING SAME, AND APPLICATION THEREOF 常州强力先端电子材料有限公司 2020-12-03 — — WO disclosed
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