SCHEMBL8527965

SCHEMBL8527965

CCNC(=O)c1c(C(C)(C)C)ccc([SiH](C)C)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
NR1H4 Q96RI1 4/20 0.36
LMNA P02545 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
HPGD P15428 2/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
PRKCZ Q05513 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
ALOX15 P16050 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HSP90AB1 P08238 2/20 0.31
EPHX2 P34913 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL8527175 0.80 PRKCZ (0.40) HDAC4HDAC1HDAC6NR1H4LMNA
SCHEMBL8531602 0.79 HDAC4 (0.38) HDAC4HDAC1HDAC6NR1H4LMNA
SCHEMBL8531871 0.79 LMNA (0.34) HDAC4HDAC1HDAC6LMNAKMT2A
SCHEMBL7217875 0.74 ALDH1A1 (0.50) NR1H4MAPTHPGDGAARAB9A
SCHEMBL8527165 0.69 PRKCZ (0.38) LMNAKMT2AMAPTMEN1HPGD
SCHEMBL7219103 0.69 GABRA1 (0.44) HDAC4HDAC1HDAC6LMNAKMT2A
SCHEMBL24252036 0.68 CTSS (0.47) LMNAKMT2AHPGDPTGS1PTGS2
SCHEMBL14726033 0.68 RAB9A (0.44) HDAC4HDAC1HDAC6KMT2AMAPT
SCHEMBL4147701 0.67 LMNA (0.46) NR1H4LMNAKMT2AMAPTMEN1
SCHEMBL4155966 0.67 ALDH1A1 (0.61) HPGDPRKCZRAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5849723-A Fungicides for the control of take-all disease of plants MONSANTO COMPANY (US) 1998-12-15 US disclosed
US-5834447-A THIOPHENE DERIVATIVES MONSANTO COMPANY (US) 1998-11-10 US disclosed
US-5811411-A Fungicides for the control of take-all disease of plants MONSANTO COMPANY (US) 1998-09-22 US disclosed
US-5705513-A HETEROCYCLIC FUNGICIDES WITH PYRIDINE OR FURAN RINGS MONSANTO COMPANY (US) 1998-01-06 US disclosed
US-5693667-A Fungicides for the control of take-all disease of plants MONSANTO COMPANY (US) 1997-12-02 US disclosed