SCHEMBL7165339

SCHEMBL7165339

COc1c(Br)cc(C(N)=O)c(N)c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
APOBEC3A P31941 1/20 0.53
HTT P42858 1/20 0.53
APOBEC3G Q9HC16 1/20 0.53
NCOA1 Q15788 1/20 0.50
NCOA3 Q9Y6Q9 1/20 0.50
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TPMT P51580 1/20 0.39
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.38
NNMT P40261 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.37
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36

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
SCHEMBL3628546 0.80 GAA (0.42) TSHRAPOBEC3AHTTAPOBEC3GALDH1A1
SCHEMBL21177391 0.79 TSHR (0.47) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL31336087 0.77 HSD17B10 (0.56) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL18786955 0.74 CA2 (0.43) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL30514835 0.74 NCOA1 (0.42) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL17403034 0.74 ERN1 (0.39) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL5243855 0.74 TSHR (0.53) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL16689305 0.73 PTPN1 (0.54) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL22060757 0.73 TSHR (0.49) TSHRAPOBEC3AHTTAPOBEC3GNCOA1
SCHEMBL27968705 0.73 ALDH1A1 (0.35) NCOA1NCOA3ALDH1A1MEN1KMT2A

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-6509334-B1 This invention relates to compounds that antagonists of the progesterone receptor, their preparation and utility. Intracellular receptors (IR) form a class of structurally related gene regulators known as \"ligand dependent AMERICAN HOME PRODUCTS CORPORATION 2003-01-21 US disclosed