SCHEMBL30162985

SCHEMBL30162985

CC(C)(C)OC(=O)N(CCO)CCn1cnc(C(N)=O)n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 1/20 0.41
▸ P2RX3 P56373 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.33
▸ AAK1 Q2M2I8 1/20 0.32
▸ LMNA P02545 3/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ ADORA1 P30542 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ EIF4E P06730 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ TOP1 P11387 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ THPO P40225 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ HTR2C P28335 1/20 0.30
▸ HTR2B P41595 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30
▸ TMEM97 Q5BJF2 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
SCHEMBL24841256 0.87 SSTR4 (0.40) SSTR4P2RX3CA14GLATMEM97
SCHEMBL24841259 0.83 LMNA (0.34) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL30162882 0.82 SMN1; SMN2 (0.36) AAK1LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL24842018 0.79 SSTR4 (0.41) SSTR4P2RX3CA14AAK1ALDH1A1
SCHEMBL30163009 0.77 SSTR4 (0.33) SSTR4P2RX3
SCHEMBL24841243 0.77 SSTR4 (0.41) SSTR4P2RX3CA14AAK1
SCHEMBL24841241 0.72 KMT2A (0.46) SSTR4P2RX3CA14AAK1SMN1; SMN2
SCHEMBL503444 0.71 CA14 (0.53) SSTR4P2RX3CA14ALDH1A1
SCHEMBL24842025 0.70 SSTR4 (0.42) SSTR4P2RX3CA14SMN1; SMN2ALDH1A1
SCHEMBL745378 0.70 CA14 (0.51) SSTR4P2RX3CA14

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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