SCHEMBL7947086

SCHEMBL7947086

COc1cccc(C(=O)c2ccccc2C)c1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
POLB P06746 3/20 0.51
KCNK3 O14649 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
RAB9A P51151 5/20 0.50
ALDH1A1 P00352 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HTT P42858 2/20 0.48
TP53 P04637 2/20 0.48
HPGD P15428 1/20 0.48
GAA P10253 4/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 2/20 0.46
USP2 O75604 1/20 0.46
MAPT P10636 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
SCHEMBL9816775 0.90 KMT2A (0.47) KMT2APOLBKCNK3KCNK9RAB9A
SCHEMBL3762150 0.89 RAB9A (0.55) KMT2APOLBRAB9AALDH1A1NPC1
SCHEMBL8467508 0.88 RAB9A (0.52) KMT2APOLBKCNK3KCNK9RAB9A
SCHEMBL9177911 0.86 KCNK3 (0.56) KMT2APOLBKCNK3KCNK9RAB9A
SCHEMBL9726590 0.84 KDM4E (0.52) KMT2APOLBKCNK3KCNK9RAB9A
SCHEMBL29120698 0.83 LMNA (0.55) KMT2APOLBRAB9AALDH1A1NPC1
SCHEMBL27787676 0.83 SMN1; SMN2 (0.51) KMT2APOLBKCNK3KCNK9RAB9A
SCHEMBL10589919 0.83 KMT2A (0.50) KMT2APOLBRAB9AALDH1A1NPC1
SCHEMBL28380549 0.82 KMT2A (0.49) KMT2APOLBRAB9AALDH1A1NPC1
SCHEMBL322169 0.81 MAPT (0.57) KMT2APOLBKCNK3KCNK9RAB9A

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-2001062083-A2 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2001-08-30 WO disclosed