SCHEMBL4811989

SCHEMBL4811989

CCSN(SCC)C(=S)c1ccc(C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
ALDH2 P05091 1/20 0.46
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NOS1 P29475 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.40
KMT2A Q03164 3/20 0.40
CA2 P00918 3/20 0.39
CA12 O43570 2/20 0.39
CA9 Q16790 2/20 0.39
RAB9A P51151 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
ABCC2 Q92887 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
UGT1A7 Q9HAW7 1/20 0.39
SLC22A11 Q9NSA0 1/20 0.39
SRD5A2 P31213 2/20 0.39
RXRA P19793 1/20 0.39

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
SCHEMBL2909667 0.80 ALDH1A1 (0.49) ALDH1A1ALDH2TP53TSHRNOS1
SCHEMBL11570423 0.79 ALDH1A1 (0.49) ALDH1A1ALDH2SMN1; SMN2HTTKMT2A
Hydrochloric Acid SCHEMBL2909153 0.79 ALDH1A1 (0.48) ALDH1A1ALDH2NOS1SMN1; SMN2KMT2A
Terephthalic Acid SCHEMBL27306913 0.71 TSHR (0.75) ALDH1A1TP53TSHRSMN1; SMN2KMT2A
Terephthalic Acid SCHEMBL1482407 0.69 TSHR (0.71) ALDH1A1TP53TSHRSMN1; SMN2CA2
Terephthalic Acid SCHEMBL30899317 0.69 TSHR (0.71) ALDH1A1TP53TSHRSMN1; SMN2CA2
Terephthalic Acid SCHEMBL11035242 0.69 TSHR (0.71) ALDH1A1TP53TSHRSMN1; SMN2CA2
Terephthalic Acid SCHEMBL10782319 0.68 TSHR (0.60) ALDH1A1TP53TSHRNOS1SMN1; SMN2
Terephthalic Acid SCHEMBL27952507 0.68 ALDH1A1 (0.60) ALDH1A1ALDH2TP53TSHRSMN1; SMN2
Terephthalic Acid SCHEMBL8092811 0.68 ALDH1A1 (0.60) ALDH1A1ALDH2TP53TSHRSMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11349643-A None JP disclosed
US-7316895-B2 Method for precipitating separation of photosensitive silver halide particle dispersion and silver salt photothermographic dry imaging material using thereof KONICA MINOLTA MEDICAL & GRAPHIC INC. (JP) 2008-01-08 US disclosed
US-20070117052-A1 METHOD FOR PRECIPITATING SEPARATION OF PHOTOSENSITIVE SILVER HALIDE PARTICLE DISPERSION AND SILVER SALT PHOTOTHERMOGRAPHIC DRY IMAGING MATERIAL USING THEREOF KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-24 US disclosed
JP-H11349643-A TEMPERATURE-SENSITIVE POLYMERIC COMPOUND, ITS PRODUCTION, TEMPERATURE-SENSITIVE POLYMER COMPOSITION, AND CELL CULTURE SUBSTRATE NITTA GELATIN INC 1999-12-21 JP disclosed