SCHEMBL9702497

SCHEMBL9702497

O=C(CCC(=O)N1CCC[C@H]1/C=N/O)NCc1ccc(Cl)cc1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
HRH3 Q9Y5N1 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 3/20 0.43
GAA P10253 1/20 0.43
POLB P06746 2/20 0.42
F2 P00734 1/20 0.42

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
SCHEMBL9702502 1.00 LMNA (0.52) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL1804892 0.89 LMNA (0.55) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL1237539 0.89 LMNA (0.55) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL9701641 0.86 LMNA (0.47) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL9701636 0.86 LMNA (0.47) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL7289930 0.80 LMNA (0.55) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL29416795 0.80 LMNA (0.55) LMNAHRH3NPC1RAB9ASMN1; SMN2
SCHEMBL7267106 0.79 TP53 (0.59) LMNATP53MAPTALDH1A1POLB
SCHEMBL9702382 0.78 DPP4 (0.63) LMNA
SCHEMBL7265568 0.78 HPGD (0.52) LMNANPC1HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5118811-A Treatment and prevention of dementia and amnesia JAPAN TOBACCO INC. (JP) 1992-06-02 US disclosed
EP-0419683-A1 NEW AMINO ACID DERIVATIVES HAVING PROLYLENDOPEPTIDASE INHIBITOR ACTIVITY Japan Tobacco Inc. (JP) 1991-04-03 EP disclosed