SCHEMBL27257535

SCHEMBL27257535

COCCC(O)c1cnccn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PSMB5 P28074 1/20 0.36
ATM Q13315 1/20 0.35
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HPGDS O60760 1/20 0.33
RAB9A P51151 1/20 0.32
KCNA5 P22460 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
POLB P06746 2/20 0.31
LONP1 P36776 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
SCHEMBL7973738 0.80 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2ATMCYP2D6
SCHEMBL27257536 0.79 KDM4E (0.35) KDM4EALDH1A1SMN1; SMN2PSMB5ATM
SCHEMBL1579715 0.76 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2ATMRAB9A
SCHEMBL5706462 0.74 KDM4E (0.34) KDM4EALDH1A1SMN1; SMN2CYP19A1
SCHEMBL10714528 0.74 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2ATMPOLB
SCHEMBL8508786 0.73 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2PSMB5CYP2D6
SCHEMBL6847249 0.72 KDM4E (0.40) KDM4EHPGD
SCHEMBL25227677 0.72 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL7117628 0.72 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2CYP19A1POLB
SCHEMBL2861698 0.72 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4618974-A1 OREXIN RECEPTOR AGONISTS Merck Sharp & Dohme LLC (US) 2025-09-24 EP disclosed
WO-2024107615-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-05-23 WO disclosed
WO-2024107615-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-05-23 WO disclosed