SCHEMBL485750

SCHEMBL485750

CC(C)c1cccc(-c2cncc(NC(=O)c3ccccc3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
GSK3B P49841 3/20 0.50
CDK7 P50613 3/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
BRAF P15056 1/20 0.49
CSF1R P07333 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
RXRG P48443 1/20 0.49
BCAT2 O15382 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CDK2 P24941 2/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 2/20 0.47
HTT P42858 1/20 0.47
NAMPT P43490 2/20 0.47
CNR1 P21554 1/20 0.46

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
SCHEMBL18881088 0.83 NPC1 (0.58) MAPTNPC1RAB9ACSF1RBCAT2
SCHEMBL19077895 0.83 NPC1 (0.58) MAPTNPC1RAB9ACSF1RBCAT2
SCHEMBL8283426 0.79 KCNK9 (0.69) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL485904 0.79 RAB9A (0.58) MAPTGSK3BCDK7NPC1RAB9A
SCHEMBL27982254 0.78 BCAT2 (0.55) MAPTGSK3BCDK7NPC1RAB9A
SCHEMBL485794 0.78 KCNK3 (0.61) MAPTGSK3BNPC1RAB9ALMNA
SCHEMBL20102192 0.77 MAPT (0.57) MAPTGSK3BBCAT2NAMPT
SCHEMBL22699716 0.77 TRPV1 (0.63) MAPTNPC1RAB9ARXRARXRB
SCHEMBL9338708 0.76 NPC1 (0.62) MAPTNPC1RAB9ABRAFSMN1; SMN2
SCHEMBL4194372 0.76 MEN1 (0.55) MAPTGSK3BSIRT2

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 12 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
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
CN-102438985-B Substituted piperidines as par-1 antagonists BAYER SCHERING PHARMA AG 2014-09-17 CN 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
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 MAPT 4722/4885GSK3B 4799/4885CDK7 2997/4885
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists F2R, F2RL1, F2RL3 MAPT 4575/4885GSK3B 3867/4885CDK7 2309/4885

“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.