SCHEMBL8308697

SCHEMBL8308697

COC(=O)c1ccc(C)c(OCCCl)c1SC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
LMNA P02545 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
SCHEMBL19700944 0.80 ALDH1A1 (0.41) MAPTKDM4EGAAL3MBTL1TSHR
SCHEMBL8306757 0.76 POLB (0.41) MAPTKDM4EL3MBTL1TDP1LMNA
SCHEMBL8309085 0.76 CYP4F2 (0.42) MAPTKDM4ENPSR1TSHRTDP1
SCHEMBL8307840 0.76 MAPT (0.41) MAPTKDM4ENPSR1TSHRTDP1
SCHEMBL6304243 0.73 PTGER4 (0.39) MAPTKDM4EGAAL3MBTL1TSHR
SCHEMBL8310463 0.72 HSD17B10 (0.38) KDM4ETHRBTSHRALDH1A1
SCHEMBL17934382 0.71 CA12 (0.42) MAPTKDM4EGAATSHRHDAC3
SCHEMBL28974025 0.71 CA12 (0.41) MAPTKDM4EGAAL3MBTL1TSHR
SCHEMBL8308537 0.70 THRA (0.33) MAPTKDM4EGAATHRBL3MBTL1
SCHEMBL8492785 0.69 ABL1 (0.42) MAPTKDM4EGAANPSR1L3MBTL1

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
EP-0918056-A1 Herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1999-05-26 EP disclosed