SCHEMBL24769578

SCHEMBL24769578

CCCCC(C(C)=O)S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.46
CA2 P00918 8/20 0.43
MAPK1 P28482 1/20 0.43
TP53 P04637 1/20 0.41
CA1 P00915 4/20 0.38
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
FDPS P14324 1/20 0.35
CHRM1 P11229 1/20 0.34
AKR1A1 P14550 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 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
SCHEMBL15345885 0.86 HDAC1 (0.42) RECQLCA2MAPK1TP53CA1
SCHEMBL169862 0.83 CA2 (0.48) RECQLCA2MAPK1TP53CA1
SCHEMBL27697229 0.81 CA2 (0.50) RECQLCA2MAPK1TP53CA1
SCHEMBL11691872 0.81 RECQL (0.45) RECQLCA2MAPK1TP53CA1
SCHEMBL6633304 0.79 RECQL (0.44) RECQLCA2MAPK1TP53CA1
SCHEMBL6629876 0.79 RECQL (0.44) RECQLCA2MAPK1TP53CA1
SCHEMBL6632177 0.78 RECQL (0.42) RECQLCA2MAPK1TP53CA1
SCHEMBL6340106 0.78 CA1 (0.53) RECQLCA2TP53CA1DPP7
SCHEMBL27845803 0.78 FOLH1 (0.38) RECQL
SCHEMBL5166316 0.77 TP53 (0.48) CA2TP53CA1LCKPPARD

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-4104865-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2022-12-21 EP disclosed