SCHEMBL1819901

SCHEMBL1819901

Cc1ccc(S(=O)(=O)N2CCOc3ccc(-c4ccc(C#N)o4)cc32)s1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ MAPT P10636 3/20 0.40
▸ TP53 P04637 1/20 0.40
▸ PDE3B Q13370 4/20 0.38
▸ PDE3A Q14432 4/20 0.38
▸ CYP2C9 P11712 1/20 0.36
▸ HTR6 P50406 1/20 0.33
▸ PGR P06401 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ SCD5 Q86SK9 1/20 0.32
▸ NPC1 O15118 1/20 0.32

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
SCHEMBL1820300 0.89 MEN1 (0.42) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1817728 0.84 KMT2A (0.41) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1819765 0.83 MEN1 (0.43) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL12818152 0.83 MEN1 (0.38) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1818993 0.82 KMT2A (0.40) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1818415 0.81 KMT2A (0.39) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1821031 0.80 KMT2A (0.41) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1819574 0.80 KMT2A (0.41) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1818795 0.80 KMT2A (0.40) KMT2AMEN1MAPTTP53PDE3B
SCHEMBL1818416 0.80 KMT2A (0.44) KMT2AMEN1MAPTTP53PDE3B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011057892-A1 2,3-DIHYDROBENZOXAZINE AND 2,3-DIHYDROBENZOTHIAZINE DERIVATES AS HIF-INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASES ELARA PHARMACEUTICALS GMBH (DE) 2011-05-19 — — WO claimed
WO-2011057892-A1 2,3-DIHYDROBENZOXAZINE AND 2,3-DIHYDROBENZOTHIAZINE DERIVATES AS HIF-INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASES ELARA PHARMACEUTICALS GMBH (DE) 2011-05-19 — — WO disclosed
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