SCHEMBL4159626

SCHEMBL4159626

CC(C)(C)OC(=O)N1CCC(CC(=O)O)(c2ccc(F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.56
TACR1 P25103 1/20 0.52
RORC P51449 4/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC2 Q92769 2/20 0.45
HDAC1 Q13547 1/20 0.45
CCR5 P51681 2/20 0.44
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.43
JAK2 O60674 1/20 0.42
JAK1 P23458 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
SCHEMBL10306289 0.89 TACR1 (0.50) HSD11B1TACR1MEN1KMT2ACCR5
SCHEMBL19226428 0.89 TACR1 (0.60) HSD11B1TACR1CCR5ALOX15TSHR
SCHEMBL4699181 0.88 TACR1 (0.48) HSD11B1TACR1RORCMEN1KMT2A
SCHEMBL17078067 0.88 MEN1 (0.51) TACR1MEN1KMT2ACCR5
SCHEMBL2427295 0.88 TACR1 (0.51) HSD11B1TACR1RORCMEN1KMT2A
SCHEMBL4542548 0.87 TACR1 (0.49) HSD11B1TACR1RORCCCR5ALOX15
SCHEMBL4162177 0.87 ALDH1A1 (0.50) HSD11B1TACR1KMT2ACCR5
SCHEMBL3327426 0.86 TACR1 (0.50) TACR1RORCMEN1KMT2AHDAC2
SCHEMBL4551945 0.86 TACR1 (0.53) HSD11B1TACR1RORCCCR5ALOX15
SCHEMBL31693832 0.86 TACR1 (0.53) HSD11B1TACR1RORCCCR5ALOX15

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
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them ALVARO GIUSEPPE 2009-07-30 US disclosed
US-20070073061-A1 Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
EP-1622871-A1 CYCLIC AMINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 2006-02-08 EP disclosed
WO-2004099143-A1 CYCLIC AMINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 2004-11-18 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-20070073061-A1 Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them SLC6A4, OPRL1, HCRTR1 HSD11B1 782/4885TACR1 9/4885RORC 3331/4885
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them SLC6A4, OPRL1, HCRTR1 HSD11B1 782/4885TACR1 9/4885RORC 3331/4885

“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.