SCHEMBL9017600

SCHEMBL9017600

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

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 2/20 0.42
NOS2 P35228 1/20 0.42
TSHR P16473 2/20 0.41
LMNA P02545 4/20 0.40
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PKMYT1 Q99640 1/20 0.38
JAK2 O60674 1/20 0.38
CYP3A4 P08684 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL9017593 0.88 POLB (0.47) NOS2TSHRLMNANPC1RAB9A
SCHEMBL9017625 0.85 PRKCZ (0.49) PRKCZNOS2TSHRLMNAMAPT
SCHEMBL20050668 0.79 PRKCZ (0.49) PRKCZNOS2TSHRLMNAMAPT
SCHEMBL30739840 0.79 PRKCZ (0.49) PRKCZNOS2TSHRLMNAMAPT
SCHEMBL7223040 0.78 HPGD (0.39) PRKCZTSHRLMNAMAPTGAA
SCHEMBL7022036 0.75 ALDH1A1 (0.40) LMNAMAPTALDH1A1KDM4EMEN1
SCHEMBL8932345 0.75 P2RX7 (0.57) PRKCZHPGDALDH1A1JAK2POLB
SCHEMBL27474595 0.75 ABL1 (0.45) TSHRLMNAMAPTGAANPC1
SCHEMBL8527175 0.74 PRKCZ (0.40) PRKCZNOS2TSHRLMNAMAPT
SCHEMBL9017618 0.73 L3MBTL1 (0.51) PRKCZNOS2TSHRLMNANPC1

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
EP-0749416-A1 SELECTED BENZAMIDE FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1996-12-27 EP disclosed
WO-1995024380-A1 SELECTED BENZAMIDE FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1995-09-14 WO disclosed