SCHEMBL3265389

SCHEMBL3265389

Cc1nn2cccc(Br)c2c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GAA P10253 1/20 0.37
▸ CYP26A1 O43174 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ RECQL P46063 1/20 0.34

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
SCHEMBL683499 0.89 POLB (0.38) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL29241266 0.80 POLB (0.45) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL21894380 0.73 POLB (0.40) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL951965 0.73 MEN1 (0.51) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL7373297 0.72 POLB (0.39) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL684214 0.72 PDE4B (0.60) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL17867572 0.71 NTRK1 (0.39) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL683558 0.71 THRB (0.44) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL28801151 0.70 POLB (0.38) POLBTDP1L3MBTL1CYP1A2CYP2C9
SCHEMBL22777570 0.69 EIF4A3 (0.45) POLBL3MBTL1MAPTPRNP

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
EP-2265603-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY The General Hospital Corporation (US) 2010-12-29 — — EP disclosed
WO-2009114180-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2009-09-17 — — WO disclosed
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