SCHEMBL9836766

SCHEMBL9836766

COc1ccc(Cl)c(NC(=O)Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.58
TDP1 Q9NUW8 1/20 0.57
HDAC1 Q13547 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
F10 P00742 1/20 0.49
HCRTR1 O43613 1/20 0.48
HCRTR2 O43614 1/20 0.48
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C19 P33261 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TYK2 P29597 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL27839544 0.86 TDP1 (0.61) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL2847925 0.86 ALDH1A1 (0.64) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL30117898 0.86 ALDH1A1 (0.64) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL3032397 0.85 TDP1 (0.56) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL9037030 0.82 TDP1 (0.54) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL30021051 0.82 TDP1 (0.61) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL5226002 0.82 TDP1 (0.54) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL20596945 0.82 POLB (0.62) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL30116223 0.82 POLB (0.62) P2RX7TDP1HDAC1HDAC8HDAC6
SCHEMBL9835549 0.81 RAB9A (0.54) KMT2AMEN1MAPTF10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed