SCHEMBL8326263

SCHEMBL8326263

CCNC(=O)c1oc([Si](C)(C)C)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.41
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.38
IP6K1 Q92551 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
MAPT P10636 1/20 0.36
PIN1 Q13526 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PARP1 P09874 1/20 0.36

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
SCHEMBL8326252 0.76 NPC1 (0.48) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL8330984 0.76 KDM4E (0.44) BRD4KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL15057591 0.69 CYP1A2 (0.36) KDM4ENPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL7219605 0.67 L3MBTL1 (0.49) BRD4HPGDALDH1A1
SCHEMBL8332147 0.67 KDM4E (0.44) BRD4KDM4ENPC1RAB9AGAA
SCHEMBL8331583 0.66 EGFR (0.50) BRD4KDM4ENPC1RAB9AALDH1A1
SCHEMBL8326221 0.66 KDM4E (0.46) BRD4KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL7329963 0.66 ELANE (0.57) KDM4EALDH1A1
SCHEMBL8328519 0.66 PTGS2 (0.47) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL4254282 0.66 KDM4E (0.46) KDM4ENPC1SMN1; SMN2GAANPSR1

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-5994270-A CONTROLLING GAEUMANNOMYCES MONSANTO COMPANY (US) 1999-11-30 US disclosed
EP-0619297-B1 Fungicides for the control of take-all desease of plants MONSANTO CO (US) 1997-06-18 EP disclosed
EP-0619297-A1 Fungicides for the control of take-all desease of plants MONSANTO COMPANY (US) 1994-10-12 EP disclosed