SCHEMBL9135833

SCHEMBL9135833

Cc1cccc(N(CC(=O)O)C(=O)CN2C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ CA12 O43570 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ KMT2A Q03164 6/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ JAK2 O60674 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ RAD52 P43351 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ POLB P06746 2/20 0.43

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
SCHEMBL9156680 0.87 ALDH1A1 (0.47) LMNATP53CA12CA9KMT2A
SCHEMBL8860030 0.87 CA12 (0.60) CA12CA9KMT2AALDH1A1NPC1
SCHEMBL9135198 0.85 CA12 (0.49) TP53CA12CA9KMT2AALDH1A1
SCHEMBL9135623 0.85 CA12 (0.46) CA12CA9KMT2AALDH1A1NPC1
SCHEMBL8828063 0.85 RAB9A (0.49) CA12CA9KMT2AALDH1A1NPC1
SCHEMBL9159771 0.84 CA12 (0.57) CA12CA9KMT2AALDH1A1NPC1
SCHEMBL9135784 0.84 LMNA (0.47) LMNATP53KMT2AALDH1A1NPC1
SCHEMBL9134700 0.84 LMNA (0.52) LMNATP53CA12CA9KMT2A
SCHEMBL9134378 0.82 CYP1A2 (0.48) CA12CA9KMT2AALDH1A1NPC1
SCHEMBL9152136 0.82 BCHE (0.54) KMT2AALDH1A1MEN1

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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