SCHEMBL10241425

SCHEMBL10241425

CC(C)(C)OC(=O)NC1CC(c2ccc(C(F)(F)F)cc2)CN(C(=O)N2CCC(C#N)CC2)C1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F2R P25116 12/20 0.73
CTSK P43235 2/20 0.41
HSD11B1 P28845 2/20 0.39
KCNA3 P22001 1/20 0.39
P2RY14 Q15391 1/20 0.39
MAPT P10636 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL662458 0.87 F2R (0.81) F2RHSD11B1
SCHEMBL10242105 0.86 F2R (0.70) F2RMAPT
SCHEMBL661018 0.84 F2R (1.00) F2R
SCHEMBL661795 0.84 F2R (0.81) F2RCTSK
SCHEMBL10241419 0.82 F2R (0.56) F2RMAPTCA1CA2
SCHEMBL640711 0.81 F2R (0.69) F2RMAPT
SCHEMBL486268 0.79 F2R (0.63) F2R
SCHEMBL3802875 0.79 F2R (0.68) F2R
Hydrochloric Acid SCHEMBL661193 0.78 F2R (0.67) F2R
SCHEMBL486495 0.78 F2R (0.69) F2RHSD11B1

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 1243/4885CTSK 2447/4885HSD11B1 3754/4885
US-20120046268-A1 Substituted piperidines as Par-1 Antagonists F2R, F2RL1, F2RL3 F2R 1/4885CTSK 568/4885HSD11B1 3803/4885

“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.