SCHEMBL7847432

SCHEMBL7847432

CON=CC(Cc1ccccc1)=NO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 3/20 0.41
ALDH1A1 P00352 8/20 0.36
MAPT P10636 5/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 3/20 0.36
MGLL Q99685 1/20 0.36
LMNA P02545 4/20 0.36
MAPK1 P28482 2/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
AKR1B1 P15121 1/20 0.35
TSHR P16473 2/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ALOX12 P18054 1/20 0.34
PPARG P37231 1/20 0.34

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
SCHEMBL11522497 0.80 CTBP2 (0.47) CTBP2ALDH1A1SMN1; SMN2MGLLCES2
SCHEMBL11573713 0.80 CTBP2 (0.47) CTBP2ALDH1A1SMN1; SMN2MGLLCES2
SCHEMBL6574736 0.72 CTBP2 (0.52) CTBP2ALDH1A1LMNAMAPK1CES2
SCHEMBL9748142 0.68 CTBP2 (0.47) CTBP2ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL9748148 0.68 CTBP2 (0.47) CTBP2ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL4435700 0.68 LMNA (0.57) ALDH1A1MAPTRAB9ANPC1LMNA
SCHEMBL13505204 0.67 ALDH1A1 (0.47) ALDH1A1MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL7875369 0.67 CTBP2 (0.50) CTBP2ALDH1A1MAPTSMN1; SMN2MGLL
SCHEMBL7875372 0.67 CTBP2 (0.50) CTBP2ALDH1A1MAPTSMN1; SMN2MGLL
SCHEMBL9278957 0.66 MAOB (0.46) ALDH1A1MAPTNPC1LMNAMAPK1

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-1131309-A2 THIOPHENDIOXIMETHER Bayer Aktiengesellschaft (DE) 2001-09-12 EP disclosed
WO-2000008003-A2 FUNGICIDE THIOPHENDIOXIMETHER BAYER AKTIENGESELLSCHAFT (DE) 2000-02-17 WO disclosed