SCHEMBL28662326

SCHEMBL28662326

CC(=O)c1ccc(C(=O)Cc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ LMNA P02545 2/20 0.66
▸ SRD5A2 P31213 2/20 0.65
▸ MAOB P27338 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ STS P08842 1/20 0.54
▸ HPGD P15428 3/20 0.53
▸ KMT2A Q03164 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ TAAR1 Q96RJ0 1/20 0.52
▸ PLAU P00749 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ CES2 O00748 1/20 0.50
▸ CES1 P23141 1/20 0.50
▸ AKR1B1 P15121 1/20 0.50

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
SCHEMBL13513241 0.94 LMNA (0.63) MAPTL3MBTL1LMNASRD5A2MAOB
SCHEMBL7129800 0.89 MAPT (0.80) MAPTL3MBTL1SRD5A2SMN1; SMN2STS
Methyl Alcohol SCHEMBL11602292 0.85 MAPT (0.68) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
SCHEMBL24800 0.85 MAPT (0.73) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
SCHEMBL1515693 0.84 L3MBTL1 (0.68) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
SCHEMBL8033816 0.83 SRD5A2 (0.89) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
SCHEMBL5260372 0.83 SRD5A2 (0.89) MAPTL3MBTL1SRD5A2SMN1; SMN2STS
Water SCHEMBL9243001 0.83 MAPT (0.70) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
Water SCHEMBL20527670 0.83 MAPT (0.70) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2
SCHEMBL4282905 0.83 MAPT (0.70) MAPTL3MBTL1LMNASRD5A2SMN1; SMN2

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
CN-109438384-B Polysubstituted 2, 4-diaryl thiazole and derivative and synthetic method thereof 湘潭大学 2021-10-22 — — CN claimed
CN-109438384-B Polysubstituted 2, 4-diaryl thiazole and derivative and synthetic method thereof 湘潭大学 2021-10-22 — — CN disclosed
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