SCHEMBL2641748

SCHEMBL2641748

C#Cc1cnn(C2CCN(C(=O)O)CC2)c1C#N

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.36
KMT2A Q03164 5/20 0.33
BCL6 P41182 2/20 0.33
RAB9A P51151 2/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NPC1 O15118 1/20 0.30
USP30 Q70CQ3 1/20 0.30

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
SCHEMBL1059433 0.83 GPR119 (0.44) GPR119
SCHEMBL2634734 0.80 GPR119 (0.36) GPR119KMT2ARAB9A
SCHEMBL1061706 0.80 GPR119 (0.44) GPR119KMT2ARAB9ANPC1
SCHEMBL2641643 0.79 GPR119 (0.37) GPR119KMT2ARAB9AUSP30
SCHEMBL2641548 0.79 GPR119 (0.35) GPR119KMT2ARAB9A
SCHEMBL21410806 0.78 KMT2A (0.32) KMT2ARAB9AUSP2ALDH1A1
SCHEMBL8512190 0.74 ALDH1A1 (0.41) GPR119KMT2AALDH1A1
SCHEMBL1059180 0.72 GPR119 (0.47) GPR119KMT2ARAB9A
SCHEMBL1059191 0.69 GPR119 (0.53) GPR119KMT2ARAB9AALDH1A1NPC1
SCHEMBL8514864 0.69 GPR119 (0.44) GPR119ALDH1A1

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-2438051-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc. (US) 2012-04-11 EP disclosed
WO-2010140092-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2010-12-09 WO disclosed