SCHEMBL2863130

SCHEMBL2863130

N#CC(=Cc1ccc(Br)s1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
KMT2A Q03164 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
EGFR P00533 4/20 0.47
KDM4E B2RXH2 2/20 0.47
CISD1 Q9NZ45 1/20 0.47
SLC16A3 O15427 1/20 0.47
CYP3A4 P08684 1/20 0.47
SLC16A1 P53985 1/20 0.47
GPR35 Q9HC97 1/20 0.47
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL2863123 1.00 LMNA (0.59) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL2857441 0.91 MAPT (0.58) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL30758474 0.81 KMT2A (0.51) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL16802906 0.80 KMT2A (0.71) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL18251173 0.80 KMT2A (0.71) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL16532973 0.79 MAPT (0.62) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL12073846 0.77 KMT2A (0.45) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL8306508 0.77 DAO (0.45) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL8306509 0.77 DAO (0.45) LMNAMAPTALDH1A1HPGDKMT2A
SCHEMBL19034419 0.76 KMT2A (0.53) MAPTALDH1A1HPGDKMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2471785-B1 Novel thiophene-based dye and preparation thereof DONGJIN SEMICHEM CO LTD (KR) 2017-04-19 EP disclosed
EP-2471784-A1 Novel thiophene-based dye and preparation thereof Dongjin Semichem Co., Ltd. (KR) 2012-07-04 EP disclosed
EP-2471785-A1 Novel thiophene-based dye and preparation thereof Dongjin Semichem Co., Ltd. (KR) 2012-07-04 EP disclosed
EP-2209773-A2 NOVEL THIOPHENE-BASED DYE AND PREPARATION THEREOF Dongjin Semichem Co., Ltd. (KR) 2010-07-28 EP disclosed
WO-2009051390-A2 NOVEL THIOPHENE-BASED DYE AND PREPARATION THEREOF DONGJIN SEMICHEM CO., LTD. (KR) 2009-04-23 WO disclosed