SCHEMBL5598091

SCHEMBL5598091

c1ccc(C2NCCNc3ccccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.55
GAA P10253 1/20 0.53
GID4 Q8IVV7 4/20 0.47
RECQL P46063 1/20 0.45
KDM1A O60341 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL18977551 0.82 PRCP (0.47) PRCPGAAGID4RECQLKDM1A
SCHEMBL11679676 0.80 PRCP (0.45) PRCPGAAGID4KDM1ADRD2
Hydrochloric Acid SCHEMBL11852646 0.79 PRCP (0.44) PRCPGAAGID4KDM1ADRD2
SCHEMBL11854994 0.76 PRCP (0.40) PRCPGAAGID4RECQLKDM1A
SCHEMBL11681688 0.76 KIF11 (0.44) PRCPGAAKDM1AMEN1KMT2A
SCHEMBL28404587 0.74 GAA (0.33) PRCPGAARECQLKDM1AMEN1
SCHEMBL11679672 0.74 USP7 (0.48) PRCPKDM1AMEN1KMT2AMAPT
SCHEMBL30423150 0.73 PDGFRA (0.41) PRCPMEN1KMT2ALMNAMAPT
SCHEMBL1045807 0.73 PDGFRA (0.41) PRCPMEN1KMT2ALMNAMAPT
SCHEMBL18977121 0.73 PRCP (0.39) PRCPGAAGID4RECQLKDM1A

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-2007072041-A1 THERAPEUTIC COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2007-06-28 WO disclosed