SCHEMBL6014184

SCHEMBL6014184

CC(C)(C)[Si](C)(C)OC[C@@H]1CCc2cccnc2C(=O)C1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.51
TOP2A P11388 1/20 0.34
FKBP1A P62942 1/20 0.32
NSD2 O96028 1/20 0.32
HRH1 P35367 2/20 0.31
HTR1A P08908 4/20 0.31
HTR2A P28223 4/20 0.31
DRD2 P14416 3/20 0.31
HTR7 P34969 2/20 0.30
CYP19A1 P11511 2/20 0.30
DUT P33316 1/20 0.30
P2RX7 Q99572 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL6014186 1.00 OPRL1 (0.51) OPRL1TOP2AFKBP1ANSD2HRH1
SCHEMBL2877475 0.80 OPRL1 (0.41) OPRL1NSD2HTR1AHTR2ADRD2
SCHEMBL13000023 0.78 OPRL1 (0.48) OPRL1NSD2HRH1HTR1AHTR2A
SCHEMBL2885507 0.76 OPRL1 (0.54) OPRL1NSD2HRH1HTR1AHTR2A
SCHEMBL2880712 0.74 OPRL1 (0.37) OPRL1
SCHEMBL12975879 0.74 OPRL1 (0.37) OPRL1
SCHEMBL12975884 0.74 OPRL1 (0.48) OPRL1HRH1DRD2
SCHEMBL30106079 0.72 FKBP1A (0.37) TOP2AFKBP1ADUT
SCHEMBL9606663 0.72 FKBP1A (0.37) TOP2AFKBP1ADUT
SCHEMBL420855 0.72 FKBP1A (0.37) TOP2AFKBP1ADUT

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-7855294-B2 Cycloalkanopyridine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-21 US disclosed
US-20070191419-A1 Cycloalkanopyridine derivative MSD K.K. (JP) 2007-08-16 US disclosed
EP-1726590-A1 CYCLOALKANOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-29 EP 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-20070191419-A1 Cycloalkanopyridine derivative OPRL1, OPRK1, AVPR2 OPRL1 1/4885TOP2A 4669/4885FKBP1A 1035/4885

“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.