SCHEMBL7658967

SCHEMBL7658967

CCC(=O)C(=Cc1cccc(Cl)c1)C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
PTGS2 P35354 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
GLO1 Q04760 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HPGD P15428 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
AKR1C3 P42330 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP12 P39900 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
SCHEMBL7658964 1.00 NR1H4 (0.49) NR1H4KMT2AMEN1PTGS2HCAR2
SCHEMBL6345435 0.88 GLO1 (0.48) NR1H4KMT2AMEN1PTGS2HCAR2
SCHEMBL6345437 0.88 GLO1 (0.48) NR1H4KMT2AMEN1PTGS2HCAR2
SCHEMBL11462566 0.86 KMT2A (0.57) NR1H4KMT2AMEN1PTGS2GLO1
SCHEMBL11552505 0.86 KMT2A (0.57) NR1H4KMT2AMEN1PTGS2GLO1
SCHEMBL6931126 0.83 HCAR2 (0.40) NR1H4KMT2AMEN1PTGS2HCAR2
SCHEMBL6931128 0.83 HCAR2 (0.40) NR1H4KMT2AMEN1PTGS2HCAR2
SCHEMBL11742324 0.83 GLO1 (0.64) NR1H4KMT2AMEN1GLO1ALDH1A1
SCHEMBL6643038 0.80 NR1H4 (0.47) NR1H4KMT2AMEN1HCAR2ALDH1A1
SCHEMBL6643040 0.80 NR1H4 (0.47) NR1H4KMT2AMEN1HCAR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6350762-B1 SELECTIVELY INHIBIT THE ACTION OF N-TYPE CALCIUM CHANNEL; AJINOMOTO CO., INC. (JP) 2002-02-26 US disclosed