SCHEMBL29125828

SCHEMBL29125828

CCC(Oc1c(Cl)cc(Cl)cc1Cl)SCc1n[nH]c(=S)o1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 12/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ HSD17B10 Q99714 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ POLB P06746 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ BACE1 P56817 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
SCHEMBL29125787 0.86 SORT1 (0.35) ALDH1A1KDM4ELMNATP53
SCHEMBL29125909 0.77 ALDH1A1 (0.57) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125852 0.75 ALDH1A1 (0.42) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125732 0.74 ALDH1A1 (0.41) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125974 0.74 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125679 0.74 ALDH1A1 (0.45) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125963 0.74 ALDH1A1 (0.61) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125915 0.74 ALDH1A1 (0.45) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125940 0.74 ALDH1A1 (0.42) ALDH1A1KDM4ELMNAHSD17B10HPGD
SCHEMBL29125823 0.71 ALDH1A1 (0.65) ALDH1A1KDM4ELMNAHSD17B10HPGD

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
CN-117247361-A Phenol-oxazolone/thioketone compound and synthetic method and application thereof 吉首大学 2023-12-19 — — CN disclosed
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