SCHEMBL5733115

SCHEMBL5733115

CCCC[Sn](CCCC)(CCCC)c1ccc(N(C)C(C)=O)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 2/20 0.37
AOC3 Q16853 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
THPO P40225 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
KMT2A Q03164 1/20 0.30
HIF1A Q16665 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL5733059 0.85 HCAR3 (0.35) HCAR3
SCHEMBL5641626 0.82 KCNH2 (0.35) HCAR3
SCHEMBL5733664 0.76 KDR (0.31)
SCHEMBL5733237 0.73 PTK2 (0.49) HCAR3CYP1A2TSHRKMT2ATDP1
SCHEMBL1674384 0.72 KMT2A (0.41) KDM4EMEN1ALDH1A1LMNACYP1A2
SCHEMBL7003724 0.72 PTGS1 (0.30)
SCHEMBL1182536 0.72 NPC1 (0.32) PKM
SCHEMBL23753409 0.71 HCAR3 (0.36) HCAR3KDM4EMEN1ALDH1A1LMNA
SCHEMBL1456734 0.71 MAPT (0.38) KDM4ECYP1A2MAPTKMT2ATDP1
SCHEMBL4560278 0.69 EPHX2 (0.46) HCAR3MAPTTSHRL3MBTL1

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-1070713-B1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2006-10-18 EP disclosed
CN-1152029-C Quinolonecarboxylic acid derivatives or salts thereof ��ɽ��ѧ��ҵ��ʽ���� 2004-06-02 CN disclosed
US-6335447-B1 BACTERICIDES TOYAMA CHEMICAL CO., LTD. (JP) 2002-01-01 US disclosed
CN-1299356-A Quinolonecarboxylic acid derivatives or salts thereof TOYAMA CHEMICAL CO LTD (JP) 2001-06-13 CN disclosed
EP-1070713-A1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2001-01-24 EP disclosed