SCHEMBL13750359

SCHEMBL13750359

CCN1C(=C(C(=O)c2ccccc2)C(=O)c2ccccc2)Sc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.51
▸ ALDH1A1 P00352 7/20 0.51
▸ HTT P42858 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ MEN1 O00255 8/20 0.48
▸ KMT2A Q03164 8/20 0.48
▸ USP2 O75604 3/20 0.48
▸ CRHBP P24387 2/20 0.48
▸ CRHR2 Q13324 2/20 0.48
▸ IDE P14735 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ POLB P06746 3/20 0.47
▸ BCHE P06276 4/20 0.46
▸ ACHE P22303 1/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL13750352 0.90 BCHE (0.52) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13750362 0.89 ALDH1A1 (0.47) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13825587 0.87 MAPT (0.51) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13757997 0.87 ALDH1A1 (0.45) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13750438 0.87 BCHE (0.55) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13750429 0.87 LMNA (0.45) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL10475163 0.86 HDAC6 (0.45) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13750346 0.86 BCHE (0.52) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL13647978 0.85 MAPT (0.49) MAPTALDH1A1HTTHPGDMEN1
SCHEMBL13750343 0.85 BCHE (0.55) MAPTALDH1A1HTTHPGDMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569688-B2 Propane-1, 3-dione derivative ASTELLAS PHARMA INC. (JP) 2009-08-04 — — US disclosed
US-7569688-B2 Propane-1, 3-dione derivative ASTELLAS PHARMA INC. (JP) 2009-08-04 — — US disclosed
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