SCHEMBL4540633

SCHEMBL4540633

O=C(NNc1ncccc1Cl)c1cccn1-c1ncccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.58
ALDH1A1 P00352 2/20 0.58
POLB P06746 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PPARG P37231 1/20 0.41
NR2E3 Q9Y5X4 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
MALT1 Q9UDY8 1/20 0.36
TRPV1 Q8NER1 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
SCHEMBL4541229 0.84 MEN1 (0.64) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL4540513 0.84 SMN1; SMN2 (0.61) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL13238941 0.79 MALT1 (0.52) GAAALDH1A1MEN1KMT2APPARG
SCHEMBL951402 0.78 POLB (0.47) POLBMEN1KMT2APPARGNR2E3
SCHEMBL4543962 0.78 MAPT (0.47) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL27748960 0.77 LMNA (0.46) MEN1KMT2APPARGNR2E3NCOR2
SCHEMBL4542777 0.76 MAPT (0.48) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL13707720 0.76 SMN1; SMN2 (0.59) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL4542982 0.75 MEN1 (0.40) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL4542470 0.74 MAPT (0.66) GAAALDH1A1POLBMEN1KMT2A

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
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed