SCHEMBL14739721

SCHEMBL14739721

O=C1C=Cc2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c2C1=NNc1ccc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
ALDH1A1 P00352 3/20 0.33
TIMP3 P35625 2/20 0.33
RECQL P46063 2/20 0.33
USP2 O75604 1/20 0.33
HSD17B10 Q99714 1/20 0.33
THRB P10828 2/20 0.32
CYP1A2 P05177 1/20 0.31
CTRB1 P17538 1/20 0.31
TNNI3 P19429 1/20 0.31
TNNT2 P45379 1/20 0.31
TNNC1 P63316 1/20 0.31
HKDC1 Q2TB90 1/20 0.31
CD40 P25942 1/20 0.31
CD40LG P29965 1/20 0.31
CDC7 O00311 1/20 0.30
EEF2K O00418 1/20 0.30
PLK4 O00444 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
SCHEMBL14388568 1.00 MEN1 (0.33) MEN1KMT2ATDP1ALDH1A1TIMP3
SCHEMBL21274240 0.88 RHOA (0.39) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL12311434 0.86 CYP1A2 (0.38) CYP1A2CTRB1TNNI3TNNT2TNNC1
SCHEMBL15115318 0.83 ALDH1A1 (0.37) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL14360805 0.83 PTPN11 (0.32)
SCHEMBL340899 0.82 THRB (0.34) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL31679136 0.82 THRB (0.34) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL30256044 0.81 KDM4E (0.38) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL19322466 0.81 KDM4E (0.38) MEN1KMT2ATDP1ALDH1A1RECQL
SCHEMBL16490257 0.81 KDM4E (0.38) MEN1KMT2ATDP1ALDH1A1RECQL

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
US-8435545-B2 Capsule having broad color spectrum Qualicaps, Inc. (US) 2013-05-07 US disclosed
US-8420057-B2 Capsule having broad color spectrum Qualicaps, Inc. (US) 2013-04-16 US disclosed
WO-2013033304-A2 CAPSULE HAVING BROAD COLOR SPECTRUM Qualicaps, Inc. (US) 2013-03-07 WO disclosed
US-20130058875-A1 CAPSULE HAVING BROAD COLOR SPECTRUM Qualicaps, Inc. 2013-03-07 US disclosed
US-20130058989-A1 CAPSULE HAVING BROAD COLOR SPECTRUM Qualicaps, Inc. 2013-03-07 US disclosed