SCHEMBL14620886

SCHEMBL14620886

CCN1/C(=C2\SC(=S)N(CC(=O)OC)C2=O)Sc2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 15/20 0.74
▸ KMT2A Q03164 15/20 0.74
▸ SMN1; SMN2 Q16637 2/20 0.66
▸ POLB P06746 5/20 0.66
▸ MAPT P10636 3/20 0.62
▸ MMP13 P45452 2/20 0.62
▸ LMNA P02545 2/20 0.57
▸ HPGD P15428 1/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ ALOX12 P18054 1/20 0.57
▸ CASP1 P29466 1/20 0.57
▸ CASP7 P55210 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.53
▸ GFER P55789 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.51
▸ NPC1 O15118 1/20 0.48
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL11267198 0.90 MEN1 (0.73) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL9191085 0.88 MEN1 (0.80) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL9191082 0.88 MEN1 (0.80) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL7019338 0.86 MEN1 (1.00) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL8887899 0.86 MEN1 (1.00) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10036060 0.86 MEN1 (1.00) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL29959615 0.83 MEN1 (0.71) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10657409 0.83 MEN1 (0.67) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10657402 0.83 MEN1 (0.67) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10661708 0.81 MEN1 (0.76) MEN1KMT2ASMN1; SMN2POLBMAPT

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-7157219-B2 Photothermographic materials containing silver halide sensitized with combination of compounds EASTMAN KODAK COMPANY (US) 2007-01-02 — — US disclosed
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