SCHEMBL29125967

SCHEMBL29125967

O=c1[nH]nc(CSCOc2cc(F)ccc2F)o1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ P2RX3 P56373 2/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ MTNR1B P49286 2/20 0.32
▸ DAO P14920 1/20 0.32
▸ SORT1 Q99523 1/20 0.31
▸ MTNR1A P48039 1/20 0.31
▸ SYK P43405 1/20 0.30

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
SCHEMBL29125739 0.88 NOTUM (0.43) NOTUMALDH1A1DAO
SCHEMBL29125719 0.85 ALDH1A1 (0.50) ALDH1A1KDM4ELMNA
SCHEMBL29128606 0.79 ADRA1D (0.30) —
SCHEMBL29125790 0.78 ALDH1A1 (0.43) NOTUMALDH1A1KDM4ELMNAIDO1
SCHEMBL29125977 0.77 MAPT (0.38) NOTUMALDH1A1MTNR1BSORT1MTNR1A
SCHEMBL29125812 0.76 ALDH1A1 (0.34) NOTUMALDH1A1KDM4ELMNAMTNR1B
SCHEMBL29125949 0.76 ALDH1A1 (0.33) ALDH1A1KDM4ELMNAMTNR1BDAO
SCHEMBL29125724 0.74 ALDH1A1 (0.38) NOTUMALDH1A1KDM4ELMNASORT1
SCHEMBL29125944 0.74 NOTUM (0.41) NOTUMALDH1A1KDM4ELMNAMTNR1B
SCHEMBL29125896 0.72 ALDH1A1 (0.55) ALDH1A1KDM4ELMNA

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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