SCHEMBL29623241

SCHEMBL29623241

O=S(=O)(O)Cc1cccc(Cl)c1-c1cnco1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
NOTUM Q6P988 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
IMPDH2 P12268 2/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
MAP4K4 O95819 1/20 0.34
POLB P06746 1/20 0.34
NAMPT P43490 1/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.33
PKM P14618 2/20 0.33

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
SCHEMBL16654920 1.00 ROCK2 (0.38) ROCK2ROCK1NOTUMCYP3A4CYP2D6
SCHEMBL22150409 0.78 PDK2 (0.43) ROCK2ROCK1IMPDH2KMT2AMEN1
SCHEMBL644836 0.78 NOTUM (0.52) ROCK2NOTUMCYP3A4CYP2D6PSEN1
Formic Acid SCHEMBL27499325 0.76 NOTUM (0.43) ROCK2ROCK1NOTUMCYP3A4CYP2D6
SCHEMBL29664573 0.71 NOTUM (0.36) ROCK2ROCK1NOTUMCYP3A4CYP2D6
SCHEMBL31076667 0.71 ROCK2 (0.36) ROCK2ROCK1NOTUMCYP3A4CYP2D6
SCHEMBL496738 0.69 ALDH1A1 (0.53) KMT2AKDM4ENPC1PKMALDH1A1
SCHEMBL2907991 0.68 PNMT (0.54) KMT2AMEN1POLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL28130066 0.68 ALDH1A1 (0.51) KMT2AKDM4ENPC1PKMALDH1A1
SCHEMBL4013559 0.67 PNMT (0.52) KMT2AMEN1POLBKDM4EALDH1A1

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-4255186-A1 STABILIZED COMPOSITIONS CONTAINING STROBILURIN FUNGICIDES AND POLYHYDRIC ALCOHOLS ADAMA MAKHTESHIM LTD. (IL) 2023-10-11 EP disclosed
WO-2022118308-A1 STABILIZED COMPOSITIONS CONTAINING STROBILURIN FUNGICIDES AND POLYHYDRIC ALCOHOLS ADAMA MAKHTESHIM LTD. (IL) 2022-06-09 WO disclosed