SCHEMBL31662033

SCHEMBL31662033

O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
POLB P06746 1/20 0.53
PREP P48147 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
CYP2C19 P33261 1/20 0.43
GRIN2B Q13224 1/20 0.42

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
SCHEMBL9640983 0.90 POLB (0.56) MEN1KMT2ANPSR1POLBPREP
SCHEMBL5345594 0.90 POLB (0.56) MEN1KMT2ANPSR1POLBPREP
SCHEMBL10595784 0.90 POLB (0.56) MEN1KMT2ANPSR1POLBPREP
SCHEMBL21807963 0.85 MEN1 (0.56) MEN1KMT2ANPSR1PREPSMN1; SMN2
SCHEMBL28698087 0.85 MEN1 (0.56) MEN1KMT2ANPSR1PREPSMN1; SMN2
SCHEMBL6907072 0.85 POLB (0.52) POLBSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL8880296 0.82 POLB (0.49) POLBPREPSMN1; SMN2NPC1RAB9A
SCHEMBL8880304 0.82 POLB (0.49) POLBPREPSMN1; SMN2NPC1RAB9A
SCHEMBL7016734 0.82 POLB (0.62) MEN1KMT2ANPSR1POLBPREP
SCHEMBL71528 0.82 POLB (0.62) MEN1KMT2ANPSR1POLBPREP

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
WO-2025149985-A1 METHODS OF PREPARING MELANOCORTIN 4 RECEPTOR AGONISTS LG CHEM, LTD. (KR) 2025-07-17 WO disclosed