SCHEMBL9926852

SCHEMBL9926852

O=C(N1CCS(=O)(=O)CC1)N1CC(CO)CC(c2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.63
CNR1 P21554 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
MCHR1 Q99705 3/20 0.37
KCNH2 Q12809 2/20 0.37
LIPE Q05469 1/20 0.36
AKR1C3 P42330 1/20 0.36
PROKR1 Q8TCW9 2/20 0.36
SLC6A9 P48067 1/20 0.36
TACR1 P25103 1/20 0.35

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
SCHEMBL3723936 0.86 F2R (0.63) F2RLIPEAKR1C3TACR1
SCHEMBL3800390 0.83 F2R (0.67) F2RCNR1TMEM97LIPEAKR1C3
SCHEMBL3799327 0.83 F2R (0.56) F2RCNR1TMEM97MCHR1PROKR1
SCHEMBL3795897 0.81 F2R (0.64) F2RCNR1TMEM97LIPEPROKR1
SCHEMBL3800392 0.81 F2R (0.64) F2RCNR1TMEM97KCNH2LIPE
SCHEMBL9894235 0.81 F2R (0.59) F2RCNR1TMEM97PROKR1
SCHEMBL662873 0.78 F2R (1.00) F2RCNR1TMEM97
SCHEMBL3766060 0.77 F2R (0.59) F2RCNR1TMEM97KCNH2
SCHEMBL3800439 0.76 F2R (0.62) F2RAKR1C3TACR1
SCHEMBL3757408 0.76 F2R (0.79) F2RCNR1TMEM97KCNH2LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435428-B1 SUBSTITUTED PIPERIDINES BAYER IP GMBH (DE) 2013-07-31 EP disclosed
US-20120149694-A1 Substituted piperidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-14 US disclosed
US-20120149694-A1 Substituted piperidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-14 US disclosed
WO-2010136128-A1 SUBSTITUTED PIPERIDINES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-12-02 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 (1 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-20120149694-A1 Substituted piperidines VHL, PIR, PIGO F2R 1339/4885CNR1 460/4885TMEM97 903/4885

“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.