SCHEMBL6763547

SCHEMBL6763547

COC(=O)NCc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
SMN1; SMN2 Q16637 5/20 0.50
GAA P10253 5/20 0.49
PKM P14618 1/20 0.49
KMT2A Q03164 6/20 0.46
ALDH1A1 P00352 5/20 0.46
MAPT P10636 5/20 0.46
KDM4E B2RXH2 3/20 0.46
POLB P06746 3/20 0.46
HPGD P15428 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 3/20 0.44
G6PD P11413 2/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL6773336 0.87 TSHR (0.58) TSHRSMN1; SMN2GAAPKMKMT2A
SCHEMBL10209975 0.86 L3MBTL1 (0.47) SMN1; SMN2GAAPKMKMT2AALDH1A1
SCHEMBL6767765 0.85 KMT2A (0.49) SMN1; SMN2GAAPKMKMT2AALDH1A1
SCHEMBL6768474 0.78 GAA (0.51) TSHRSMN1; SMN2GAAPKMKMT2A
SCHEMBL6768315 0.77 GAA (0.58) SMN1; SMN2GAAPKMKMT2AALDH1A1
SCHEMBL5972423 0.76 TRPV1 (0.51) GAAKMT2AALDH1A1MAPTKDM4E
SCHEMBL7252186 0.76 TSHR (0.69) TSHRSMN1; SMN2PKMKMT2AALDH1A1
SCHEMBL6767607 0.76 PDE3B (0.54) SMN1; SMN2GAAPKMKMT2AALDH1A1
SCHEMBL6421064 0.75 NR1H4 (0.59) KMT2AMEN1
SCHEMBL3609489 0.75 TSHR (0.64) TSHRSMN1; SMN2PKMKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed