SCHEMBL6556281

SCHEMBL6556281

CCOC(Cn1cncc(NC(=O)OCc2ccccc2)c1=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
POLB P06746 1/20 0.43
ELANE P08246 10/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CTRC Q99895 1/20 0.40
MAOB P27338 1/20 0.40
KMT2A Q03164 1/20 0.39
CASP3 P42574 1/20 0.39
SCD O00767 1/20 0.39

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
SCHEMBL6557730 0.82 NPC1 (0.49) NPC1RAB9APOLBELANESMN1; SMN2
SCHEMBL6556060 0.81 ELANE (0.51) NPC1RAB9AELANE
SCHEMBL6556294 0.80 NPC1 (0.47) NPC1RAB9APOLBELANESMN1; SMN2
SCHEMBL6557678 0.79 ELANE (0.60) NPC1RAB9AELANECTRC
SCHEMBL6556313 0.78 ELANE (0.55) POLBELANE
SCHEMBL6558195 0.77 ELANE (0.55) ELANECTRC
SCHEMBL27467031 0.77 ELANE (0.49) NPC1RAB9AELANECASP3
SCHEMBL6558295 0.77 ELANE (0.62) ELANE
SCHEMBL6556275 0.76 ELANE (0.57) ELANECTRC
SCHEMBL6557643 0.76 ELANE (0.64) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-5948785-A USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. THE GREEN CROSS CORPORATION (JP) 1999-09-07 US disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed