SCHEMBL30270990

SCHEMBL30270990

CC(C)(C)OC(=O)N1CCN(c2cc(=O)n3nc(Br)sc3n2)CC12CC2

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 5/20 0.41
▸ ITGA2B P08514 8/20 0.38
▸ ITGB3 P05106 1/20 0.38
▸ ACKR3 P25106 2/20 0.38
▸ JAK3 P52333 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SPR P35270 1/20 0.33
▸ NR1H2 P55055 1/20 0.33
▸ NR1H3 Q13133 1/20 0.33

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
SCHEMBL30270968 0.83 ACKR3 (0.49) RETITGA2BITGB3ACKR3SMN1; SMN2
SCHEMBL30271032 0.79 RET (0.37) RETITGA2BSMN1; SMN2
SCHEMBL31396179 0.78 RET (0.41) RETJAK3NR1H2NR1H3
SCHEMBL31396262 0.74 ALDH1A1 (0.42) RETJAK3NR1H2NR1H3
SCHEMBL31267843 0.74 RET (0.45) RETJAK3SPRNR1H2NR1H3
SCHEMBL31396207 0.73 RET (0.41) RETJAK3SPRNR1H2NR1H3
SCHEMBL25074106 0.73 JAK3 (0.40) RETJAK3SPRNR1H2NR1H3
SCHEMBL24091519 0.71 GPR119 (0.47) RETJAK3NR1H2NR1H3
SCHEMBL31713482 0.71 RET (0.52) RETJAK3
SCHEMBL31713549 0.71 RET (0.52) RETJAK3

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-4416156-A1 COMPOUNDS AND METHODS FOR MODULATING NUCLEIC ACID SPLICING Remix Therapeutics Inc. (US) 2024-08-21 — — EP disclosed
WO-2023064879-A1 COMPOUNDS AND METHODS FOR MODULATING NUCLEIC ACID SPLICING REMIX THERAPEUTICS INC. (US) 2023-04-20 — — WO disclosed
EP-4132936-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2023-02-15 — — EP disclosed
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