SCHEMBL28777630

SCHEMBL28777630

CC1(OC(N)=O)CCN(c2c(C=O)cnc(C#N)c2-c2cc(F)cc(F)c2)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SSTR2 P30874 3/20 0.32
▸ PDE9A O76083 3/20 0.31
▸ RET P07949 2/20 0.31
▸ ALDH1A1 P00352 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
SCHEMBL28777625 1.00 SSTR2 (0.32) SSTR2PDE9ARETALDH1A1
SCHEMBL28777551 0.88 PTPN11 (0.35) —
SCHEMBL28777549 0.88 PTPN11 (0.35) —
SCHEMBL28944328 0.84 CGAS (0.33) SSTR2PDE9ARET
SCHEMBL28944327 0.84 CGAS (0.33) SSTR2PDE9ARET
SCHEMBL22976301 0.82 RET (0.36) RET
SCHEMBL22976297 0.82 RET (0.36) RET
SCHEMBL28777665 0.82 JAK1 (0.36) RET
SCHEMBL28777664 0.82 JAK1 (0.36) RET
SCHEMBL28777460 0.81 SSTR2 (0.33) SSTR2

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
CN-114585614-A Non-peptide somatostatin type 5 receptor agonists and uses thereof 克林提克斯医药股份有限公司 2022-06-03 — — CN disclosed
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