SCHEMBL8527175

SCHEMBL8527175

CCNC(=O)c1c(C(C)(C)C)ccc(N)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 2/20 0.40
HDAC1 Q13547 2/20 0.39
HDAC4 P56524 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
NR1H4 Q96RI1 3/20 0.37
NOS2 P35228 1/20 0.36
HSP90AB1 P08238 3/20 0.36
BRAF P15056 1/20 0.35
LMNA P02545 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
DDR1 Q08345 1/20 0.34
ALOX15 P16050 3/20 0.33

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
SCHEMBL20050668 0.81 PRKCZ (0.49) PRKCZHDAC1NOS2BRAFLMNA
SCHEMBL30739840 0.81 PRKCZ (0.49) PRKCZHDAC1NOS2BRAFLMNA
SCHEMBL8531602 0.81 HDAC4 (0.38) PRKCZHDAC1HDAC4HDAC6PTGS1
SCHEMBL8527965 0.80 HDAC4 (0.38) PRKCZHDAC1HDAC4HDAC6PTGS1
SCHEMBL7217875 0.76 ALDH1A1 (0.50) NR1H4MAPTHPGDGAARAB9A
SCHEMBL9017625 0.75 PRKCZ (0.49) PRKCZHDAC1NOS2HSP90AB1BRAF
SCHEMBL9017600 0.74 PRKCZ (0.42) PRKCZNOS2LMNAMAPTMEN1
SCHEMBL11657258 0.72 PRKCZ (0.46) PRKCZNOS2HSP90AB1LMNAMAPT
SCHEMBL7219103 0.71 GABRA1 (0.44) HDAC1HDAC4HDAC6PTGS1PTGS2
SCHEMBL24252036 0.70 CTSS (0.47) PTGS1PTGS2LMNAHPGDKMT2A

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
US-5834447-A THIOPHENE DERIVATIVES MONSANTO COMPANY (US) 1998-11-10 US disclosed