SCHEMBL23584696

SCHEMBL23584696

CC1C[C@@H](CN2CCC(F)(F)C2)O[C@H]1c1ccc2c(N)ncnn12

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.33
▸ MBOAT4 Q96T53 1/20 0.32
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ FGFR1 P11362 2/20 0.31
▸ DOT1L Q8TEK3 1/20 0.31

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
SCHEMBL19344174 0.83 POLRMT (0.32) POLRMTMBOAT4DPP4DPP8DPP9
SCHEMBL13696066 0.79 DOT1L (0.37) POLRMTDOT1L
SCHEMBL13532219 0.79 DOT1L (0.37) POLRMTDOT1L
SCHEMBL20058766 0.79 DOT1L (0.37) POLRMTDOT1L
SCHEMBL23584490 0.73 — —
SCHEMBL22435122 0.73 POLRMT (0.34) POLRMT
SCHEMBL19344308 0.73 POLRMT (0.34) POLRMT
SCHEMBL9912317 0.72 DOT1L (0.35) POLRMTDOT1L
SCHEMBL18666890 0.72 HSPA5 (0.36) POLRMTDOT1L
SCHEMBL13696400 0.72 DOT1L (0.35) POLRMTDOT1L

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-3426664-B1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-06-30 — — EP disclosed
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