SCHEMBL6282473

SCHEMBL6282473

NC(=O)c1cnc2c(c1)CCO2

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NNMT P40261 7/20 0.51
TSHR P16473 1/20 0.39
PARP1 P09874 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGDS O60760 1/20 0.38
PRKCI P41743 1/20 0.37
PIK3CA P42336 1/20 0.36
PSMD14 O00487 1/20 0.36
STAMBP O95630 1/20 0.36
COPS5 Q92905 1/20 0.36
CYP11B2 P19099 1/20 0.35
CHEK1 O14757 1/20 0.35
CHEK2 O96017 1/20 0.35
PI4K2A Q9BTU6 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL30427718 1.00 NNMT (0.51) NNMTTSHRPARP1SMN1; SMN2HPGDS
SCHEMBL25787753 0.92 NNMT (0.52) NNMTTSHRSMN1; SMN2HPGDSPRKCI
SCHEMBL10650921 0.86 MGAM (0.41) NNMTPSMD14LMNA
SCHEMBL31003073 0.85 NNMT (0.36) NNMTSMN1; SMN2PRKCICYP11B2
SCHEMBL25789750 0.81 MAPK1 (0.41) SMN1; SMN2PSMD14CYP11B2LMNA
SCHEMBL25787974 0.79 TSHR (0.54) NNMTTSHRSMN1; SMN2HPGDSPIK3CA
SCHEMBL17371695 0.77 GRM1 (0.44) NNMTSMN1; SMN2
SCHEMBL4481718 0.76 NNMT (0.49) NNMTTSHRSMN1; SMN2HPGDSPSMD14
SCHEMBL16495711 0.73 NNMT (0.56) NNMTSMN1; SMN2HPGDSPSMD14STAMBP
SCHEMBL29664524 0.72 NPC1 (0.43) NNMTTSHRSMN1; SMN2HPGDSCHEK1

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
US-6878705-B2 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxamide antiviral agents PFIZER (US) 2005-04-12 US claimed
WO-2023129512-A1 BICYCLIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, COMPOSITIONS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-07-06 WO disclosed