SCHEMBL440043

SCHEMBL440043

CCOC(=O)c1cnc2c(F)cccc2c1N

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.68
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
MAPT P10636 3/20 0.51
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 3/20 0.48
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
USP2 O75604 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
CSNK1D P48730 1/20 0.46

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
SCHEMBL438878 0.87 KMT2A (0.71) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL4152079 0.86 MAPT (0.52) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL440812 0.86 KMT2A (0.70) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL442163 0.85 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL437697 0.85 KMT2A (0.68) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL440533 0.85 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL440425 0.85 KMT2A (0.68) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL10126200 0.85 KMT2A (0.68) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL2719292 0.85 KMT2A (0.68) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL436627 0.84 KMT2A (0.67) KMT2ANPC1RAB9AMAPTMEN1

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
US-20120065166-A1 Bone Modulators And Methods Therewith ESPINA VIRGINIA (US) 2012-03-15 US disclosed