SCHEMBL9134971

SCHEMBL9134971

CN(C)c1ccc(N(CC(=O)O)C(=O)CN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ ALDH1A1 P00352 7/20 0.50
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ POLB P06746 2/20 0.46
▸ GAA P10253 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.41
▸ RAD52 P43351 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
SCHEMBL8860030 0.90 CA12 (0.60) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9152697 0.89 ALDH1A1 (0.50) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9159771 0.88 CA12 (0.57) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9133596 0.86 ALDH1A1 (0.59) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9134942 0.83 MEN1 (0.46) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL8860020 0.83 ALDH1A1 (0.55) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9135833 0.81 LMNA (0.49) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9154018 0.81 ALDH1A1 (0.50) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9158223 0.80 ALDH1A1 (0.55) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL9157633 0.79 ALDH1A1 (0.48) CA12CA9ALDH1A1KMT2AMEN1

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-5475106-A Agonist for cholecystokinin and gastrin receptors; nervous system, gastrointestinal disorders RHONE-POULENC RORER S.A. (FR) 1995-12-12 — — US disclosed
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