SCHEMBL6971381

SCHEMBL6971381

[CH2]OC(=O)c1cc(C)n(C)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.48
TDP1 Q9NUW8 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
KDM4E B2RXH2 3/20 0.47
MAPK1 P28482 3/20 0.47
PKM P14618 1/20 0.47
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
RAB9A P51151 4/20 0.43
GAA P10253 3/20 0.43
MAPT P10636 6/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 2/20 0.41
USP2 O75604 2/20 0.41
TP53 P04637 2/20 0.41
CASP1 P29466 1/20 0.41
BRCA1 P38398 1/20 0.41
CASP7 P55210 1/20 0.41

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
SCHEMBL6971384 0.82 KDM4E (0.48) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL11359782 0.79 TSHR (0.56) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL1041466 0.75 NOTUM (0.53) ALDH1A1KMT2AMEN1
SCHEMBL2930813 0.74 L3MBTL1 (0.44) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL14226107 0.71 MAPT (0.36) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL13687490 0.71 L3MBTL1 (0.39) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL13740220 0.69 ALDH1A1 (0.55) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL17815671 0.67 GAA (0.54) L3MBTL1MAPK1ALDH1A1RAB9AGAA
SCHEMBL1426662 0.66 CYP1A2 (0.60) L3MBTL1TDP1CTDSP1KDM4EMAPK1
SCHEMBL6960892 0.65 KDM4E (0.32) KDM4ELMNATP53

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed