SCHEMBL29125950

SCHEMBL29125950

CCC(Oc1ccc(Br)cc1Br)SCc1n[nH]c(=O)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ TSHR P16473 4/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MAPK1 P28482 3/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL29125900 0.89 LMNA (0.34) LMNASMN1; SMN2ATMTSHRNPC1
SCHEMBL29126038 0.82 KMT2A (0.38) LMNAKMT2AHSD17B10TSHRGLA
SCHEMBL29125810 0.81 KMT2A (0.39) LMNAKMT2AHSD17B10TSHRGLA
SCHEMBL29128522 0.80 LMNA (0.36) LMNASMN1; SMN2ATMTSHRNPC1
SCHEMBL29125816 0.77 TSHR (0.39) LMNAKMT2AHSD17B10SMN1; SMN2TSHR
SCHEMBL29125951 0.76 TSHR (0.42) LMNAKMT2AHSD17B10TSHRGLA
SCHEMBL29125960 0.74 GLA (0.37) LMNAKMT2AHSD17B10TSHRNPC1
SCHEMBL29126008 0.74 TSHR (0.43) LMNAKMT2AHSD17B10TSHRGLA
SCHEMBL29125723 0.74 LMNA (0.40) LMNAKMT2AHSD17B10SMN1; SMN2TSHR
SCHEMBL29128364 0.73 LMNA (0.34) LMNASMN1; SMN2ATMTSHRMAPK1

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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