SCHEMBL2857441

SCHEMBL2857441

N#CC(=Cc1ccc(-c2ccc(Br)s2)s1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
LMNA P02545 1/20 0.51
APP P05067 1/20 0.47
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
EGFR P00533 4/20 0.43
KDM4E B2RXH2 3/20 0.43
CISD1 Q9NZ45 1/20 0.43
SLC16A3 O15427 1/20 0.43
CYP3A4 P08684 1/20 0.43
SLC16A1 P53985 1/20 0.43
GPR35 Q9HC97 1/20 0.43
MEN1 O00255 3/20 0.41
MAPK1 P28482 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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 0.91 LMNA (0.59) MAPTLMNAALDH1A1KMT2AHPGD
SCHEMBL2863130 0.91 LMNA (0.59) MAPTLMNAALDH1A1KMT2AHPGD
SCHEMBL12870046 0.82 KMT2A (0.60) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL16541510 0.82 KMT2A (0.60) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL21160634 0.82 MAPT (0.58) MAPTAPPALDH1A1KMT2AHPGD
SCHEMBL16532896 0.81 MAPT (0.57) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL15859151 0.81 MAPT (0.74) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL15859149 0.81 MAPT (0.74) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL14730414 0.81 MAPT (0.74) MAPTLMNAAPPALDH1A1KMT2A
SCHEMBL23388720 0.80 MAPT (0.59) MAPTLMNAAPPALDH1A1KMT2A

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