SCHEMBL27092934

SCHEMBL27092934

Nc1ncnc2c1ncn2[C@@H]1C[C@H](C[Se]CCC(N)C(=O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNMT P50135 1/20 0.73
AHCY P23526 9/20 0.61
ADORA2B P29275 1/20 0.61
PRMT5 O14744 3/20 0.55
NSD2 O96028 2/20 0.55
PCMT1 P22061 2/20 0.55
DOT1L Q8TEK3 2/20 0.55
SETD7 Q8WTS6 2/20 0.55
NNMT P40261 2/20 0.55
TRDMT1 O14717 1/20 0.55
RNMT O43148 1/20 0.55
INMT O95050 1/20 0.55
TPMT P51580 1/20 0.55
METTL3 Q86U44 1/20 0.55
CARM1 Q86X55 1/20 0.55
EHMT2 Q96KQ7 1/20 0.55
NSD1 Q96L73 1/20 0.55
PRMT1 Q99873 1/20 0.55
SETD2 Q9BYW2 1/20 0.55
NSD3 Q9BZ95 1/20 0.55

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
SCHEMBL27092929 1.00 HNMT (0.73) HNMTAHCYADORA2BPRMT5NSD2
SCHEMBL25864245 0.87 HNMT (0.75) HNMTAHCYADORA2BPRMT5NSD2
SCHEMBL27092976 0.84 HNMT (1.00) HNMTAHCYADORA2BPRMT5NSD2
SCHEMBL27092971 0.84 HNMT (1.00) HNMTAHCYADORA2BPRMT5NSD2
SCHEMBL28157647 0.80 NNMT (0.76) HNMTPRMT5NSD2PCMT1DOT1L
SCHEMBL27092948 0.80 NNMT (0.76) HNMTPRMT5NSD2PCMT1DOT1L
SCHEMBL27092943 0.80 NNMT (0.76) HNMTPRMT5NSD2PCMT1DOT1L
SCHEMBL17079892 0.80 NNMT (0.76) HNMTPRMT5NSD2PCMT1DOT1L
SCHEMBL17079889 0.80 NNMT (0.76) HNMTPRMT5NSD2PCMT1DOT1L
SCHEMBL27092925 0.80 NNMT (0.57) HNMTPRMT5NSD2PCMT1DOT1L

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4324928-A1 SYNTHETIC REAGENTS FOR ENZYME-CATALYSED ALKYLATION Universität Basel (CH) 2024-02-21 EP claimed
EP-4324928-A1 SYNTHETIC REAGENTS FOR ENZYME-CATALYSED ALKYLATION Universität Basel (CH) 2024-02-21 EP disclosed