SCHEMBL18953533

SCHEMBL18953533

O=C(O)Nc1cccc(NC(=O)c2ccccc2)c1

nearest known ligand 0.89

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 11/20 0.89
▸ KCNK9 Q9NPC2 9/20 0.89
▸ SIRT1 Q96EB6 1/20 0.77
▸ KMT2A Q03164 5/20 0.75
▸ MEN1 O00255 4/20 0.75
▸ POLB P06746 1/20 0.75
▸ TP53 P04637 1/20 0.72
▸ NPC1 O15118 2/20 0.69
▸ RAB9A P51151 2/20 0.69
▸ HPGD P15428 1/20 0.69
▸ ALDH1A1 P00352 1/20 0.66
▸ MAPT P10636 1/20 0.66
▸ LPAR3 Q9UBY5 1/20 0.66

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
SCHEMBL2298254 0.94 KCNK3 (1.00) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL14715912 0.90 KCNK3 (0.92) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL14715827 0.90 KCNK3 (0.92) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL14715832 0.88 KCNK3 (0.88) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL19491390 0.87 SIRT1 (1.00) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL14715821 0.86 KCNK3 (0.85) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL15177198 0.86 KCNK3 (0.77) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL18953510 0.86 RAB9A (0.78) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL22305399 0.86 KCNK3 (0.83) KCNK3KCNK9SIRT1KMT2AMEN1
SCHEMBL11858223 0.85 GPR35 (0.67) KCNK3KCNK9SIRT1KMT2AMEN1

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
WO-2017098421-A1 BENZOTHIADIAZINE COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-06-15 — — WO disclosed
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