SCHEMBL2914728

SCHEMBL2914728

CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1N1CCN(C(=O)O)CC1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.70
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
MAPT P10636 6/20 0.58
NPSR1 Q6W5P4 5/20 0.58
LMNA P02545 4/20 0.58
ALDH1A1 P00352 3/20 0.58
MAPK10 P53779 1/20 0.56
GAA P10253 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HTT P42858 2/20 0.53
GLA P06280 1/20 0.53
MAPK1 P28482 1/20 0.51

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
SCHEMBL2943134 0.87 PDGFRB (0.63) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL27486435 0.84 MAPT (0.77) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL30080115 0.84 PDGFRB (0.59) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL23726472 0.84 PDGFRB (0.59) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL2919716 0.83 PDGFRB (1.00) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL29055040 0.83 PDGFRB (0.58) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL23727245 0.82 PDGFRB (0.57) PDGFRBMEN1KMT2AMAPTNPSR1
Hydrochloric Acid SCHEMBL23726881 0.82 PDGFRB (0.57) PDGFRBMEN1KMT2AMAPTNPSR1
Hydrochloric Acid SCHEMBL30080064 0.82 PDGFRB (0.57) PDGFRBMEN1KMT2AMAPTNPSR1
SCHEMBL2912881 0.82 PDGFRB (1.00) PDGFRB

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
EP-0882717-B1 NITROGENOUS HETEROCYCLIC COMPOUNDS KYOWA HAKKO KIRIN CO LTD (JP) 2010-09-08 EP disclosed