SCHEMBL9171182

SCHEMBL9171182

CC(=O)C(=O)c1ccc(OC[C]=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ GAA P10253 1/20 0.44
▸ CES2 O00748 2/20 0.44
▸ CES1 P23141 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ PTPRC P08575 4/20 0.42
▸ PTPN1 P18031 4/20 0.42
▸ PTPN2 P17706 1/20 0.42
▸ PTPRF P10586 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41
▸ MAOB P27338 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PLK1 P53350 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL9353433 0.85 L3MBTL1 (0.63) MAPTLMNAPOLBNPSR1L3MBTL1
SCHEMBL8011558 0.79 PKM (0.58) POLBL3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL8727410 0.79 MAPT (0.68) MAPTLMNAPOLBL3MBTL1GAA
SCHEMBL2170360 0.78 CA12 (0.42) MAPTLMNAPOLBNPSR1L3MBTL1
SCHEMBL11086552 0.78 PARP10 (0.61) ALDH1A1PARP10MAOB
SCHEMBL10402918 0.78 LMNA (0.53) MAPTLMNAPOLBNPSR1L3MBTL1
SCHEMBL9553897 0.77 MAPT (0.45) MAPTLMNAPOLBNPSR1L3MBTL1
SCHEMBL13889134 0.76 ALOX15 (0.57) MAPTCES2CES1ALDH1A1
SCHEMBL11082868 0.75 GABRA1 (0.46) MAPTLMNAPOLBNPSR1L3MBTL1
SCHEMBL9175561 0.75 MAPT (0.42) MAPTLMNAPOLBNPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0383190-B1 Ribonucleotide reductase inhibitors BIO MEGA BOEHRINGER INGELHEIM (CA) 1995-06-14 — — EP disclosed
US-5198425-A Bactericides BIO-MEGA, INC. (CA) 1993-03-30 — — US disclosed
US-5071835-A Antitumor agents BIO-MEGA INC. (CA) 1991-12-10 — — US disclosed
EP-0383190-A2 Ribonucleotide reductase inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1990-08-22 — — EP disclosed
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