SCHEMBL11539893

SCHEMBL11539893

NC(=O)ON=C1CCOc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
LMNA P02545 1/20 0.39
MAPT P10636 7/20 0.38
ALDH1A1 P00352 3/20 0.38
PLA2G1B P04054 2/20 0.38
ATG4B Q9Y4P1 2/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
PKM P14618 3/20 0.36
KDM4E B2RXH2 1/20 0.36
CTSL P07711 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
SLC9A1 P19634 1/20 0.35
PIK3CA P42336 2/20 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
SCHEMBL11539890 1.00 NOTUM (0.47) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL12609459 0.87 NOTUM (0.43) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL11540587 0.83 NOTUM (0.40) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL11539391 0.83 NOTUM (0.40) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL11540152 0.80 LMNA (0.41) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL11540155 0.80 LMNA (0.41) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL10313139 0.80 USP9X (0.36) NOTUMMAPTALDH1A1PLA2G1BATG4B
SCHEMBL433887 0.79 MAPK8 (0.43) NOTUMLMNAMAPTALDH1A1PLA2G1B
SCHEMBL11540354 0.78 MTNR1A (0.41) NOTUMLMNAMAPTALDH1A1HPGD
SCHEMBL17146135 0.78 MEN1 (0.40) NOTUMLMNAMAPTALDH1A1L3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4169097-A GASTRIC ANTISECRETORY AGENTS MORTON-NORWICH PRODUCTS, INC. (US) 1979-09-25 US claimed
US-4169097-A GASTRIC ANTISECRETORY AGENTS MORTON-NORWICH PRODUCTS, INC. (US) 1979-09-25 US disclosed
US-4169097-A GASTRIC ANTISECRETORY AGENTS MORTON-NORWICH PRODUCTS, INC. (US) 1979-09-25 US disclosed
US-4169097-A GASTRIC ANTISECRETORY AGENTS MORTON-NORWICH PRODUCTS, INC. (US) 1979-09-25 US disclosed