SCHEMBL24842025

SCHEMBL24842025

CC(C)(C)OC(=O)N(CCO)CCn1ccc(C(=O)NO)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 1/20 0.42
▸ HDAC1 Q13547 4/20 0.35
▸ CA14 Q9ULX7 1/20 0.34
▸ P2RX3 P56373 1/20 0.34
▸ RAB9A P51151 7/20 0.34
▸ NPC1 O15118 6/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ AR P10275 1/20 0.33
▸ HDAC3 O15379 3/20 0.32
▸ HDAC10 Q969S8 3/20 0.32
▸ HDAC6 Q9UBN7 3/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ HCRTR2 O43614 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HDAC4 P56524 2/20 0.31

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
SCHEMBL24841241 0.89 KMT2A (0.46) SSTR4CA14P2RX3RAB9ANPC1
SCHEMBL24842018 0.86 SSTR4 (0.41) SSTR4CA14P2RX3RAB9ANPC1
SCHEMBL30162686 0.78 KMT2A (0.37) SSTR4CA14P2RX3RAB9ANPC1
SCHEMBL30162944 0.76 SSTR4 (0.34) SSTR4P2RX3
SCHEMBL24841256 0.72 SSTR4 (0.40) SSTR4CA14P2RX3POLB
SCHEMBL30162985 0.70 SSTR4 (0.41) SSTR4CA14P2RX3SMN1; SMN2ALDH1A1
SCHEMBL503444 0.70 CA14 (0.53) SSTR4HDAC1CA14P2RX3ALDH1A1
SCHEMBL24842027 0.70 SSTR4 (0.38) SSTR4CA14P2RX3ALDH1A1HCRTR1
SCHEMBL24842019 0.69 HDAC1 (0.46) HDAC1RAB9ANPC1SMN1; SMN2HDAC3
SCHEMBL745378 0.68 CA14 (0.51) SSTR4HDAC1CA14P2RX3HDAC3

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-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO disclosed
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