SCHEMBL25028115

SCHEMBL25028115

OCc1ccc(-c2nc3cc4sc(-c5ccc(CO)o5)nc4cc3s2)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.46
▸ KDM4E B2RXH2 5/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ RIPK2 O43353 1/20 0.38
▸ APP P05067 2/20 0.38
▸ CLK4 Q9HAZ1 2/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ CLK1 P49759 1/20 0.36
▸ CLK2 P49760 1/20 0.36

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
SCHEMBL25028195 0.79 CYP2C19 (0.50) CYP2C19KDM4ERAB9ANPC1ALDH1A1
SCHEMBL23954304 0.76 MAPT (0.42) KDM4ERAB9ANPC1ATMALDH1A1
SCHEMBL25028029 0.71 APP (0.47) KDM4ERAB9ANPC1ATMALDH1A1
SCHEMBL24304833 0.71 ALDH1A1 (0.55) CYP2C19KDM4ERAB9ANPC1ALDH1A1
SCHEMBL25028313 0.70 ILK (0.49) KDM4ERAB9ANPC1ATMALDH1A1
SCHEMBL8411578 0.69 ALDH1A1 (0.53) CYP2C19KDM4ERAB9ANPC1ALDH1A1
SCHEMBL31712298 0.68 RAB9A (0.58) CYP2C19KDM4ERAB9ANPC1ATM
SCHEMBL25028059 0.66 MMP2 (0.53) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL10424579 0.65 MAPT (0.62) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL7812948 0.65 IDO1 (0.52) CYP2C19KDM4ERAB9ANPC1ALDH1A1

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
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 — — US disclosed
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