SCHEMBL7983472

SCHEMBL7983472

CCCS(=O)(=O)NC(=O)c1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.52
FLT4 P35916 1/20 0.52
KDR P35968 1/20 0.52
SMN1; SMN2 Q16637 6/20 0.48
KMT2A Q03164 2/20 0.48
HPGD P15428 4/20 0.47
F2R P25116 1/20 0.46
GAA P10253 2/20 0.44
KCNA5 P22460 1/20 0.44
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
POLB P06746 1/20 0.43
TYK2 P29597 1/20 0.43
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
SLC6A9 P48067 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL7973404 0.88 FLT1 (0.56) FLT1FLT4KDRSMN1; SMN2KMT2A
SCHEMBL7990897 0.84 F2R (0.46) FLT1FLT4KDRKMT2AHPGD
SCHEMBL7973458 0.83 ALDH1A1 (0.49) SMN1; SMN2KMT2AHPGDF2RKCNA5
SCHEMBL7991909 0.83 HPGD (0.56) SMN1; SMN2KMT2AHPGDF2RGAA
SCHEMBL7990936 0.83 HPGD (0.55) FLT1FLT4KDRSMN1; SMN2KMT2A
SCHEMBL7987112 0.80 CTSD (0.58) SMN1; SMN2KMT2AHPGDGAAALDH1A1
SCHEMBL7973398 0.80 KCNA5 (0.41) KMT2AHPGDF2RGAAKCNA5
SCHEMBL7984835 0.79 HCRTR1 (0.60) KMT2AHPGDGAAALDH1A1RAB9A
SCHEMBL7973501 0.78 PTPN1 (0.53) FLT1FLT4KDRKMT2AHPGD
SCHEMBL6654274 0.78 MYC (0.61) FLT1FLT4KDRSMN1; SMN2HPGD

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-6331628-B1 REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-18 US disclosed