SCHEMBL25948690

SCHEMBL25948690

CSc1ncnn2c(C3CCC(COCc4ccccc4)O3)ccc12

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 4/20 0.45
▸ HRH3 Q9Y5N1 4/20 0.45
▸ LMNA P02545 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.31
▸ HSPA5 P11021 1/20 0.30
▸ PDE2A O00408 1/20 0.30
▸ DRD1 P21728 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
SCHEMBL23584542 1.00 HRH4 (0.45) HRH4HRH3LMNATAAR1HSPA5
SCHEMBL23584717 0.85 HRH4 (0.47) HRH4HRH3LMNATAAR1HSPA5
SCHEMBL20144183 0.85 HRH4 (0.47) HRH4HRH3LMNATAAR1HSPA5
SCHEMBL19343957 0.83 PDE4D (0.34) HRH4HRH3LMNAPDE2ADRD1
SCHEMBL18571687 0.80 CYP2A6 (0.37) —
SCHEMBL23584545 0.80 CYP2A6 (0.37) —
SCHEMBL17106780 0.78 HTR1A (0.41) PDE2A
SCHEMBL22002160 0.78 HTR1A (0.41) PDE2A
SCHEMBL29937697 0.78 HTR1A (0.41) PDE2A
SCHEMBL19343951 0.78 HTR1A (0.41) PDE2A

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
EP-4219496-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 — — EP disclosed
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