SCHEMBL486001

SCHEMBL486001

CCOC(=O)c1ccc(C2CNCC(NC(=O)c3ccccc3)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 1/20 0.50
GAA P10253 1/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CHRM1 P11229 5/20 0.45
ABL1 P00519 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
RIN1 Q13671 1/20 0.44
CHRM5 P08912 2/20 0.43
CHRM4 P08173 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM3 P20309 1/20 0.42
HPGD P15428 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
SCHEMBL13191794 0.89 MASP2 (0.43) SMN1; SMN2NPC1GAARAB9AMEN1
SCHEMBL31091721 0.86 GRM5 (0.45) SMN1; SMN2NPC1GAARAB9AMEN1
SCHEMBL485823 0.80 F2R (0.58) NPC1RAB9AKMT2AHPGD
SCHEMBL15984686 0.79 CA1 (0.54) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL27982262 0.79 F2R (0.42) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL485729 0.79 F2R (0.61) CHRM1CHRM2
SCHEMBL486028 0.78 F2R (0.56) NPC1RAB9AMEN1KMT2A
SCHEMBL486000 0.78 HPGD (0.42) MEN1KMT2ACHRM1HPGD
SCHEMBL31386276 0.78 CA1 (0.46) NPC1RAB9AABL1MAPTHTT
SCHEMBL10188744 0.77 RAB9A (0.57) SMN1; SMN2NPC1GAARAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411363-B1 SUBSTITUTED PIPERIDINES AS PAR-1 ANTAGONISTS BAYER IP GMBH (DE) 2015-10-07 EP disclosed
US-20150183773-A1 Substituted piperidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-02 US disclosed
US-20150183773-A1 Substituted piperidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-02 US disclosed
US-8987248-B2 Substituted piperidines as Par-1 antagonists BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-03-24 US disclosed
US-8987248-B2 Substituted piperidines as Par-1 antagonists BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-03-24 US disclosed
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-02-23 US disclosed
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-02-23 US disclosed
EP-2411363-A1 SUBSTITUTED PIPERIDINES AS PAR-1 ANTAGONISTS Bayer Pharma AG (DE) 2012-02-01 EP disclosed
WO-2010108608-A1 SUBSTITUTED PIPERIDINES AS PAR-1 ANTAGONISTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150183773-A1 Substituted piperidines VHL, PIR, PIGO SMN1; SMN2 1869/4885NPC1 168/4885GAA 857/4885
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists F2R, F2RL1, F2RL3 SMN1; SMN2 3678/4885NPC1 871/4885GAA 3333/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.