SCHEMBL662458

SCHEMBL662458

N#CC1CCN(C(=O)N2CC(NC(=O)O)CC(c3ccc(C(F)(F)F)cc3)C2)CC1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2R P25116 14/20 0.81
LIPE Q05469 1/20 0.40
USP30 Q70CQ3 2/20 0.39
HSD11B1 P28845 1/20 0.39
PROKR1 Q8TCW9 1/20 0.38
MCHR1 Q99705 1/20 0.38

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
SCHEMBL661795 0.91 F2R (0.81) F2R
SCHEMBL661018 0.89 F2R (1.00) F2R
SCHEMBL10241425 0.87 F2R (0.73) F2RHSD11B1
SCHEMBL663323 0.85 F2R (0.81) F2R
SCHEMBL486495 0.85 F2R (0.69) F2RLIPEUSP30HSD11B1
SCHEMBL640711 0.84 F2R (0.69) F2RLIPEPROKR1
SCHEMBL3802875 0.83 F2R (0.68) F2RLIPEPROKR1MCHR1
Hydrochloric Acid SCHEMBL661193 0.82 F2R (0.67) F2RLIPEPROKR1MCHR1
SCHEMBL486332 0.82 F2R (0.64) F2RLIPEUSP30PROKR1MCHR1
SCHEMBL662187 0.80 F2R (0.64) F2RLIPE

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
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-20120046268-A1 Substituted piperidines as Par-1 Antagonists BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-02-23 US 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 F2R 1243/4885LIPE 1801/4885USP30 1291/4885
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists F2R, F2RL1, F2RL3 F2R 1/4885LIPE 1692/4885USP30 2434/4885

“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.