SCHEMBL11318409

SCHEMBL11318409

CCN(Oc1ccc(Sc2ccccc2)cc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
THRB P10828 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
SLC6A9 P48067 1/20 0.36
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL2065189 0.85 LMNA (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL11312712 0.84 ALDH1A1 (0.38) HPGDALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11310669 0.82 ALDH1A1 (0.50) HPGDALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL11312887 0.79 ELANE (0.55) HPGDALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11306390 0.77 L3MBTL1 (0.54) ALDH1A1SMN1; SMN2MMP2MMP9MMP12
SCHEMBL6191583 0.76 MAPT (0.50) HPGDALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL10880334 0.74 NPC1 (0.48) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL27466888 0.73 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2LMNAMAPTL3MBTL1
SCHEMBL8820368 0.73 CYP3A4 (0.42) MEN1KMT2ALMNAL3MBTL1NPC1
SCHEMBL6236145 0.71 L3MBTL1 (0.41) ALDH1A1SMN1; SMN2LMNAMAPTL3MBTL1

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-0004334-B1 CARBAMATES AND THEIR PESTICIDAL COMPOSITIONS, PREPARATIONS THEREOF AND USE THEREOF AS PESTICIDES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-10-21 EP claimed