SCHEMBL9768979

SCHEMBL9768979

Cc1ccc(S(=O)(=O)O)c(C)c1NNc1c(Cl)cc(S(=O)(=O)O)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
S1PR2 O95136 1/20 0.35
S1PR4 O95977 1/20 0.35
S1PR3 Q99500 1/20 0.35
CASR P41180 2/20 0.35
CA2 P00918 1/20 0.35
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
KCNJ6 P48051 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
CASP6 P55212 1/20 0.33
IDH1 O75874 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL9768977 0.75 CA2 (0.42) ALDH1A1KMT2AMEN1FLT1FLT4
SCHEMBL31531993 0.70 FLT1 (0.50) ALDH1A1KMT2AFLT1FLT4KDR
SCHEMBL3386873 0.70 FLT1 (0.50) ALDH1A1KMT2AFLT1FLT4KDR
SCHEMBL8636120 0.70 CASR (0.47) ALDH1A1KMT2AMEN1FLT1FLT4
SCHEMBL11310253 0.69 GNG2 (0.35) ALDH1A1KMT2AMEN1S1PR2S1PR4
SCHEMBL11718837 0.69 CASR (0.39) ALDH1A1KMT2AFLT1FLT4KDR
SCHEMBL9828277 0.69 MEN1 (0.44) ALDH1A1KMT2AMEN1CASRMAPT
SCHEMBL8887429 0.69 FLT1 (0.49) ALDH1A1KMT2AFLT1FLT4KDR
Hydrochloric Acid SCHEMBL3866369 0.69 FLT1 (0.49) ALDH1A1KMT2AFLT1FLT4KDR
SCHEMBL13277970 0.69 FLT1 (0.49) ALDH1A1KMT2AFLT1FLT4KDR

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
US-5021558-A Color strength, fastness HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-04 US disclosed