SCHEMBL9866804

SCHEMBL9866804

COCCNS(=O)(=O)c1cccc(OCc2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
KAT8 Q9H7Z6 1/20 0.44
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 8/20 0.42
LMNA P02545 4/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 1/20 0.42
TRPV3 Q8NET8 1/20 0.39
HTT P42858 2/20 0.39
ALOX15 P16050 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GLRA3 O75311 1/20 0.38
GLRB P48167 1/20 0.38
PHGDH O43175 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL9865969 0.81 TRPV3 (0.45) KAT8MAPK1ALDH1A1LMNAHPGD
SCHEMBL9866236 0.80 POLB (0.48) POLBMAPK1ALDH1A1LMNAHPGD
SCHEMBL9867413 0.79 TRPV3 (0.46) POLBKAT8MAPK1ALDH1A1LMNA
SCHEMBL9866569 0.78 AR (0.51) POLBKAT8HPGDNPC1SMN1; SMN2
SCHEMBL9866681 0.78 KAT8 (0.47) KAT8ALDH1A1LMNATRPV3MEN1
SCHEMBL9865599 0.77 KAT8 (0.41) KAT8LMNAHPGDNPC1SMN1; SMN2
SCHEMBL9866578 0.76 TRPV3 (0.44) POLBKAT8MAPK1ALDH1A1LMNA
SCHEMBL9865486 0.75 KMT2A (0.43) KAT8ALDH1A1SMN1; SMN2TRPV3HTT
SCHEMBL9867938 0.75 POLB (0.51) POLBMAPK1ALDH1A1LMNAHPGD
SCHEMBL9734839 0.74 CA1 (0.50) KAT8ALDH1A1KDM4ETRPV3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987141-A DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-22 US disclosed
CN-1042144-A Pesticidal compound ICI PLC (GB) 1990-05-16 CN disclosed
EP-0356029-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 EP disclosed