SCHEMBL19904812

SCHEMBL19904812

CNCCN(C)Cc1n[nH]cc1-c1cc(CCC(C)C)cc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 4/20 0.37
▸ NOS1 P29475 2/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ PRMT6 Q96LA8 5/20 0.33
▸ PRMT8 Q9NR22 2/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ TACR1 P25103 1/20 0.31
▸ NOS3 P29474 1/20 0.30
▸ PRMT3 O60678 1/20 0.30
▸ CARM1 Q86X55 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
SCHEMBL19904807 0.90 PRMT1 (0.38) PRMT1NOS1NOS2PRMT6PRMT8
SCHEMBL19904816 0.87 PRMT1 (0.37) PRMT1NOS1NOS2PRMT6PRMT8
SCHEMBL16124062 0.86 PRMT1 (0.38) PRMT1NOS1NOS2PRMT6PRMT8
SCHEMBL16124060 0.85 PRMT1 (0.36) PRMT1PRMT6PRMT8
SCHEMBL19904830 0.84 PRMT1 (0.42) PRMT1NOS1NOS2PRMT6PRMT8
SCHEMBL16129003 0.83 PRMT1 (0.37) PRMT1PRMT6PRMT8PRMT3CARM1
SCHEMBL16129081 0.81 PRMT1 (0.37) PRMT1PRMT6PRMT8PRMT3CARM1
SCHEMBL19432338 0.80 PRMT1 (0.37) PRMT1PRMT6PRMT8PRMT3CARM1
SCHEMBL16204216 0.80 PRMT6 (0.35) PRMT1PRMT6PRMT8CARM1
SCHEMBL16129069 0.78 PRMT1 (0.38) PRMT1PRMT6PRMT8PRMT3CARM1

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-2970134-B1 PYRAZOLE DERIVATIVES AS PRMT1 INHIBITORS AND USES THEREOF EPIZYME INC (US) 2018-02-28 — — EP disclosed
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