SCHEMBL292608

SCHEMBL292608

CC1(C)CN(c2ccc(F)cc2F)C(=O)CN1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.39
OPRM1 P35372 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
GLA P06280 1/20 0.36
P2RX7 Q99572 2/20 0.36
ALDH1A1 P00352 3/20 0.35
GRM5 P41594 3/20 0.34
HTR1A P08908 2/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34

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
SCHEMBL291498 0.89 AR (0.42) AROPRM1P2RX7GRM5HTR1A
SCHEMBL291908 0.87 HTR7 (0.40) AROPRM1P2RX7HTR7
SCHEMBL292188 0.86 P2RX7 (0.43) P2RX7
SCHEMBL292828 0.84 HTR7 (0.40) ARP2RX7HTR7
SCHEMBL291229 0.83 SLC6A2 (0.40) ARP2RX7HTR1AADRA1AADRA1B
SCHEMBL292232 0.83 AR (0.36) AR
SCHEMBL292960 0.82 MEN1 (0.53) AROPRM1ALDH1A1GRM5OPRL1
SCHEMBL292131 0.79 AR (0.43) ARGRM5CYP3A4HSD11B1
SCHEMBL292093 0.79 AR (0.41) AROPRM1ADRA1DADRA1AADRA1B
SCHEMBL291655 0.78 MEN1 (0.40) AROPRM1DRD2HTR7OPRL1

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-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 AR 329/4885OPRM1 138/4885CA12 4320/4885

“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.