SCHEMBL30892255

SCHEMBL30892255

COC(=O)c1c(Cl)c(Br)cc(Cl)c1OC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ALDH1A1 P00352 4/20 0.42
GAA P10253 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TAS1R3 Q7RTX0 4/20 0.41
TAS1R1 Q7RTX1 4/20 0.41
TAS1R2 Q8TE23 3/20 0.40
HPGD P15428 3/20 0.40
TPMT P51580 2/20 0.39
TSHR P16473 2/20 0.39
DRD2 P14416 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GALK1 P51570 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL17318733 1.00 POLB (0.46) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL16048561 0.85 POLB (0.45) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL17318740 0.85 ALDH1A1 (0.56) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL30892257 0.85 ALDH1A1 (0.56) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL19079893 0.85 POLB (0.44) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL6828036 0.82 POLB (0.45) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL19079896 0.81 HSP90B1 (0.41) POLBGAAKDM4EHPGDTSHR
SCHEMBL31069592 0.81 POLB (0.41) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL4831712 0.76 ALDH1A1 (0.58) POLBALDH1A1GAAKDM4EHSD17B10
SCHEMBL31573601 0.75 ALDH1A1 (0.51) POLBALDH1A1GAAKDM4ETAS1R3

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
CN-112299983-B 3, 6-Dichloro salicylic acid compounds and related methods of synthesis 孟山都技术公司 2024-05-17 CN disclosed