SCHEMBL25952190

SCHEMBL25952190

C=C(Cl)c1ccn(C2OC(COc3cc4ncc(C#N)c(Cl)c4cc3OC)[C@H]3OC(C)(C)O[C@@H]23)c1/N=C\N

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 17/20 0.35
▸ EGFR P00533 2/20 0.35
▸ MAP2K1 Q02750 1/20 0.34
▸ ABL1 P00519 8/20 0.34
▸ ABL2 P42684 6/20 0.34
▸ ERBB2 P04626 1/20 0.33
▸ BCR P11274 2/20 0.32
▸ FYN P06241 1/20 0.32

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
SCHEMBL18572864 0.79 PRMT5 (0.42) SRCMAP2K1
SCHEMBL18571891 0.79 SRC (0.39) SRCEGFRMAP2K1ABL1ABL2
SCHEMBL18572869 0.72 PRMT5 (0.43) —
SCHEMBL18571815 0.68 PRMT5 (0.53) —
SCHEMBL18572314 0.67 PRMT5 (0.48) —
SCHEMBL18571889 0.67 PRMT5 (0.39) —
SCHEMBL18572300 0.66 PRMT5 (0.45) —
SCHEMBL18571895 0.65 ENPP1 (0.37) EGFRERBB2
SCHEMBL22002166 0.65 ENPP1 (0.37) EGFRERBB2
SCHEMBL22002269 0.65 SRC (0.36) SRCEGFRABL1ABL2ERBB2

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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