SCHEMBL10107298

SCHEMBL10107298

CC1(c2cc(C(F)(F)F)ccc2O[C@H]2C[C@H]3CC[C@@H](C2)N3c2ccc(C(F)(F)F)cn2)OCCO1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 2/20 0.37
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
PDE10A Q9Y233 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ABL1 P00519 1/20 0.34
LMNA P02545 1/20 0.34
IKBKE Q14164 1/20 0.34
TBK1 Q9UHD2 1/20 0.34
SCD O00767 4/20 0.33
ACACB O00763 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
HRH3 Q9Y5N1 3/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL13799822 1.00 CXCR3 (0.37) CXCR3CCNA2CDK2PDE10AKDM4E
SCHEMBL425105 1.00 CXCR3 (0.37) CXCR3CCNA2CDK2PDE10AKDM4E
SCHEMBL16433635 0.94 SYK (0.36) CXCR3CCNA2CDK2PDE10AKDM4E
SCHEMBL12961963 0.83 CXCR3 (0.38) CXCR3KDM4EABL1LMNAIKBKE
SCHEMBL12961964 0.81 CXCR3 (0.40) CXCR3KDM4EABL1LMNAIKBKE
SCHEMBL385891 0.81 HCRTR1 (0.41) KDM4EABL1LMNASCDHRH3
SCHEMBL10107103 0.81 HCRTR1 (0.41) KDM4EABL1LMNASCDHRH3
SCHEMBL10107138 0.80 LMNA (0.41) KDM4EABL1LMNASCDHRH3
SCHEMBL13799813 0.80 KDM4E (0.41) KDM4EABL1LMNASCDACACB
SCHEMBL10107254 0.80 KDM4E (0.41) KDM4EABL1LMNASCDACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE45364-E1 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2015-02-03 US disclosed
US-8101768-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2012-01-24 US disclosed
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-7485727-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2009-02-03 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-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
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 (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-20080045569-A1 Cyclic Amine Compound and Pest Control Agent H1-0, H1-2, H1-4 CXCR3 2950/4885CCNA2 1375/4885CDK2 2997/4885
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-0, H1-2, H1-4 CXCR3 3019/4885CCNA2 1251/4885CDK2 3027/4885

“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.