SCHEMBL5263107

SCHEMBL5263107

CNC(=O)c1cccc(Cl)c1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.49
▸ GAA P10253 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ DOT1L Q8TEK3 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41
▸ TAS1R2 Q8TE23 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ ULK1 O75385 1/20 0.41
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MAPT P10636 1/20 0.40

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
SCHEMBL4143751 0.81 TAS1R3 (0.60) PLK1GAAALDH1A1POLBTAS1R3
SCHEMBL883582 0.80 POLB (0.69) PLK1GAAALDH1A1POLBL3MBTL1
SCHEMBL30452120 0.80 POLB (0.69) PLK1GAAALDH1A1POLBL3MBTL1
SCHEMBL27944839 0.79 PLK1 (0.50) PLK1GAAALDH1A1POLBHDAC8
SCHEMBL10126900 0.79 TAS1R3 (0.54) PLK1GAAALDH1A1POLBL3MBTL1
SCHEMBL3780962 0.79 DOT1L (0.50) PLK1GAAALDH1A1POLBL3MBTL1
SCHEMBL5696499 0.79 TSHR (0.45) ALDH1A1POLBTAS1R3TAS1R1TAS1R2
SCHEMBL28784207 0.78 TSHR (0.48) ALDH1A1POLBTSHRCES2CES1
SCHEMBL3786271 0.78 PLK1 (0.57) PLK1GAAALDH1A1POLBL3MBTL1
SCHEMBL24311514 0.78 GAA (0.56) PLK1GAAALDH1A1POLBL3MBTL1

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-1817297-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES Pfizer Products Inc. (US) 2007-08-15 — — EP disclosed
WO-2006056854-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES PFIZER PRODUCTS INC. (US) 2006-06-01 — — WO disclosed
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