SCHEMBL8567759

SCHEMBL8567759

COc1cc(OC)c(C)c(C(=O)N(C)c2ccccc2-c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
CD274 Q9NZQ7 4/20 0.41
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 2/20 0.41
PDCD1 Q15116 2/20 0.41
TACR1 P25103 2/20 0.40
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 2/20 0.39
GAA P10253 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
SCHEMBL8570522 0.84 NPC1 (0.46) MEN1KMT2ACD274ALDH1A1L3MBTL1
SCHEMBL8567749 0.75 SMN1; SMN2 (0.54) NPSR1MEN1KMT2ATAS1R3TAS1R1
SCHEMBL8569641 0.75 MEN1 (0.47) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL8572769 0.74 TACR1 (0.45) MEN1KMT2AALDH1A1SMN1; SMN2TACR1
SCHEMBL8573485 0.74 MEN1 (0.42) MEN1KMT2ACD274ALDH1A1L3MBTL1
SCHEMBL8568184 0.71 TACR1 (0.59) TACR1
SCHEMBL1651653 0.70 KDM4E (0.49) NPSR1ALDH1A1L3MBTL1LMNASMN1; SMN2
SCHEMBL8569426 0.69 TACR1 (0.42) MEN1KMT2AALDH1A1SMN1; SMN2TACR1
SCHEMBL28201220 0.69 HSD17B2 (0.51) NPSR1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8572561 0.69 TACR1 (0.45) MEN1KMT2AALDH1A1SMN1; SMN2HTT

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-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US disclosed