SCHEMBL28465083

SCHEMBL28465083

Oc1ccccc1OC=S

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.50
TP53 P04637 2/20 0.50
CA1 P00915 1/20 0.50
TSHR P16473 1/20 0.50
MAPT P10636 4/20 0.46
LMNA P02545 3/20 0.46
GAA P10253 3/20 0.46
JAK2 O60674 1/20 0.46
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
HPGD P15428 2/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
CA12 O43570 1/20 0.41
GMNN O75496 1/20 0.41
EGFR P00533 1/20 0.41

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
SCHEMBL5077616 0.76 CA2 (0.50) CA2TP53CA1TSHRMAPT
SCHEMBL29773031 0.76 CA2 (0.50) CA2TP53CA1TSHRMAPT
SCHEMBL1883142 0.76 TSHR (0.50) CA2TP53CA1TSHRMAPT
SCHEMBL194334 0.76 CA2 (0.56) CA2TP53CA1TSHRMAPT
SCHEMBL10640071 0.73 TP53 (0.52) CA2TP53CA1TSHRMAPT
SCHEMBL9260031 0.73 CA2 (0.52) CA2TP53CA1TSHRMAPT
SCHEMBL8517929 0.73 CA2 (0.52) CA2TP53CA1TSHRMAPT
SCHEMBL10747442 0.71 ALDH1A1 (0.31) CA2CA1ALDH1A1HPGDCA12
SCHEMBL6574818 0.71 HTR7 (0.38) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL1702501 0.71 CA2 (0.50) CA2TP53CA1TSHRMAPT

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
CN-111748069-A Optical resin composition and optical resin material prepared from same 万华化学集团股份有限公司 2020-10-09 CN claimed
CN-118064541-A Method for evaluating proper microbial starter 浙江工商大学 2024-05-24 CN disclosed