SCHEMBL11434078

SCHEMBL11434078

Nc1cccc(C(=O)Nc2cc(O)cc3cc(S(=O)(=O)O)ccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 3/20 0.50
▸ CTDSP1 Q9GZU7 1/20 0.50
▸ KAT6A Q92794 1/20 0.48
▸ APEX1 P27695 1/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ NSD2 O96028 1/20 0.46
▸ DUSP3 P51452 1/20 0.46
▸ PTPN5 P54829 1/20 0.46
▸ PTPN11 Q06124 1/20 0.46
▸ HDAC1 Q13547 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL11763835 0.92 APEX1 (0.53) CASP6CTDSP1KAT6AAPEX1HSD17B10
SCHEMBL11439331 0.91 CASP6 (0.50) CASP6CTDSP1KAT6AAPEX1HSD17B10
SCHEMBL11436204 0.87 CASP6 (0.65) CASP6CTDSP1APEX1HSD17B10NSD2
SCHEMBL10905184 0.85 KMT2A (0.47) CASP6CTDSP1APEX1HSD17B10NSD2
SCHEMBL11342887 0.85 TIMP3 (0.55) CASP6CTDSP1APEX1HSD17B10NSD2
SCHEMBL11433757 0.84 HSD17B10 (0.50) CASP6CTDSP1KAT6AAPEX1HSD17B10
SCHEMBL11439509 0.84 RAB9A (0.55) CTDSP1SMN1; SMN2DUSP3PTPN5PTPN11
SCHEMBL11425329 0.83 CASP6 (0.66) CASP6CTDSP1KAT6AAPEX1HSD17B10
SCHEMBL11435673 0.82 CASP6 (0.48) CASP6CTDSP1APEX1HSD17B10NSD2
SCHEMBL11426327 0.82 CASP6 (0.48) CASP6CTDSP1APEX1HSD17B10SMN1; SMN2

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-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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