SCHEMBL2664192

SCHEMBL2664192

O=C(N/N=C/c1cccc(/C=C/COc2ccccc2)c1)c1ccc(O)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADCYAP1R1 P41586 6/20 0.64
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
SPHK2 Q9NRA0 4/20 0.55
SPHK1 Q9NYA1 4/20 0.55
GCGR P47871 6/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
POLB P06746 1/20 0.52
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50

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
SCHEMBL2664047 0.92 ADCYAP1R1 (0.72) ADCYAP1R1NPC1RAB9ASPHK2SPHK1
SCHEMBL2664459 0.89 ADCYAP1R1 (0.55) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664199 0.85 ADCYAP1R1 (0.62) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664458 0.85 GCGR (0.58) ADCYAP1R1NPC1RAB9ASPHK2SPHK1
SCHEMBL2664188 0.85 GCGR (0.70) ADCYAP1R1GCGR
SCHEMBL9072264 0.84 ADCYAP1R1 (0.55) ADCYAP1R1NPC1RAB9ASPHK2SPHK1
SCHEMBL2664333 0.83 GCGR (0.56) ADCYAP1R1NPC1RAB9ASPHK2SPHK1
SCHEMBL2664364 0.82 ADCYAP1R1 (0.60) ADCYAP1R1NPC1RAB9ASPHK2SPHK1
SCHEMBL2664645 0.82 ADCYAP1R1 (0.61) ADCYAP1R1GCGR
SCHEMBL2664426 0.81 ADCYAP1R1 (0.56) ADCYAP1R1NPC1RAB9AGCGRMEN1

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-1999001423-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 1999-01-14 WO disclosed