SCHEMBL10107166

SCHEMBL10107166

COc1cc(C(F)(F)F)ccc1O[C@@H]1[C@@H]2CCC[C@H]1CN(c1ccc(C(F)(F)F)cn1)C2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 6/20 0.53
HCRTR2 O43614 5/20 0.53
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
ABL1 P00519 1/20 0.42
ACACB O00763 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
HSD11B1 P28845 3/20 0.39
HRH3 Q9Y5N1 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SYK P43405 1/20 0.37

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
SCHEMBL12932352 0.96 HCRTR1 (0.55) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL382980 0.90 HCRTR1 (0.46) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL10107157 0.90 HCRTR1 (0.46) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL1066934 0.88 HCRTR1 (0.49) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL10107160 0.86 HCRTR1 (0.46) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL1066135 0.86 HCRTR1 (0.46) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL385013 0.84 HCRTR1 (0.51) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL10107126 0.84 HCRTR1 (0.51) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL16433615 0.84 HCRTR1 (0.44) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL16433616 0.83 HCRTR1 (0.46) HCRTR1HCRTR2KDM4ELMNAABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101768-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2012-01-24 US disclosed
US-7868178-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2011-01-11 US disclosed
US-20090143443-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2009-06-04 US disclosed
US-7485727-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2009-02-03 US disclosed
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-12-25 US disclosed
US-20080045569-A1 Cyclic Amine Compound and Pest Control Agent NIPPON SODA CO., LTD. (JP) 2008-02-21 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 (3 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-20080045569-A1 Cyclic Amine Compound and Pest Control Agent H1-0, H1-2, H1-4 HCRTR1 41/4885HCRTR2 202/4885KDM4E 373/4885
US-20090143443-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT TAAR1, CBR3, CBR1 HCRTR1 13/4885HCRTR2 60/4885KDM4E 1169/4885
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-0, H1-2, H1-4 HCRTR1 50/4885HCRTR2 260/4885KDM4E 339/4885

“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.