SCHEMBL7422298

SCHEMBL7422298

CN[C@H]1CCN(Cc2ccnc(C#N)c2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
F10 P00742 9/20 0.41
F2 P00734 3/20 0.41
FNTA P49354 6/20 0.40
FNTB P49356 6/20 0.40
PGGT1B P53609 6/20 0.40
KCNH2 Q12809 2/20 0.40
CYP3A4 P08684 1/20 0.40
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35

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
SCHEMBL7423003 0.84 FNTA (0.53) PRMT5WDR77FNTAFNTBPGGT1B
SCHEMBL8428326 0.83 F10 (0.61) F10F2
SCHEMBL27493161 0.82 PRMT5 (0.44) PRMT5WDR77F10F2FNTA
SCHEMBL7418476 0.82 PRMT5 (0.44) PRMT5WDR77F10F2FNTA
SCHEMBL7424116 0.82 PRMT5 (0.44) PRMT5WDR77F10F2FNTA
SCHEMBL2332098 0.82 F2 (0.39) PRMT5WDR77F10F2FNTA
SCHEMBL7422999 0.81 SRC (0.48) PRMT5WDR77F10F2FNTA
SCHEMBL7419382 0.80 FNTA (0.42) PRMT5WDR77F10F2FNTA
SCHEMBL27479463 0.80 PRMT5 (0.43) PRMT5WDR77F10F2KCNH2
SCHEMBL7424685 0.79 FNTA (0.49) F10FNTAFNTBPGGT1BKCNH2

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
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed