SCHEMBL13258136

SCHEMBL13258136

CNC(=O)c1ccc2nc(C(=O)Nc3ccc(-c4ccc(C)cc4SOOO)c(S(=O)(=O)O)c3)[nH]c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ RECQL P46063 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ DGAT1 O75907 4/20 0.36
▸ GAA P10253 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MMP2 P08253 2/20 0.35
▸ MMP9 P14780 2/20 0.35
▸ MMP8 P22894 2/20 0.35
▸ MMP13 P45452 2/20 0.35
▸ HPSE Q9Y251 1/20 0.35
▸ CHEK2 O96017 3/20 0.35
▸ BLK P51451 1/20 0.34
▸ PIN1 Q13526 1/20 0.34

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
SCHEMBL13283611 0.89 POLB (0.43) POLBMAPTALDH1A1MEN1RECQL
SCHEMBL19750318 0.74 MAPT (0.41) POLBMAPTALDH1A1LMNADGAT1
SCHEMBL13376087 0.73 NPC1 (0.41) POLBALDH1A1MEN1KMT2ADGAT1
SCHEMBL18053141 0.73 HDAC6 (0.40) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL13258133 0.72 CA1 (0.42) POLBALDH1A1MEN1KMT2AHSD17B10
SCHEMBL13258128 0.72 KMT2A (0.45) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL17213006 0.71 MEN1 (0.49) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL10020305 0.71 KMT2A (0.33) POLBMAPTALDH1A1MEN1RECQL
SCHEMBL13258131 0.70 HPGD (0.40) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL13376091 0.70 KMT2A (0.36) POLBMAPTALDH1A1MEN1KMT2A

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-20100190015-A1 Organic Polymer Compound, Optical Film and Method of Production Thereof CRYSOPTIX KK (JP) 2010-07-29 — — US disclosed
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