SCHEMBL29125728

SCHEMBL29125728

Fc1ccc(OCCCSCc2n[nH]c(=S)o2)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ LMNA P02545 1/20 0.58
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ RECQL P46063 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ POLB P06746 2/20 0.35
▸ PPARG P37231 1/20 0.34
▸ NCOA2 Q15596 1/20 0.34
▸ NCOA1 Q15788 1/20 0.34

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
SCHEMBL29125790 0.86 ALDH1A1 (0.43) ALDH1A1KDM4ELMNAALOX15TSHR
SCHEMBL29125905 0.79 ALDH1A1 (0.61) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29125668 0.79 ALDH1A1 (0.61) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29125775 0.79 ALDH1A1 (0.60) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29125779 0.79 ALDH1A1 (0.44) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29128332 0.78 ALDH1A1 (0.34) ALDH1A1KDM4ELMNAALOX15TSHR
SCHEMBL29125719 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL30788514 0.76 ALDH1A1 (0.74) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29125903 0.76 ALDH1A1 (0.88) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29125896 0.75 ALDH1A1 (0.55) ALDH1A1KDM4ELMNAMEN1KMT2A

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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