SCHEMBL20162137

SCHEMBL20162137

CC(=O)N1CCc2cc(C(=O)Nc3cn(Cc4cccc(C(F)(F)F)c4)cn3)ccc2C1OC(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.42
TAS2R8 Q9NYW2 1/20 0.40
KCNH2 Q12809 1/20 0.40
P2RY14 Q15391 1/20 0.38
PTGER4 P35408 2/20 0.38
ABCB1 P08183 1/20 0.37
DRD4 P21917 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
PTGER2 P43116 1/20 0.36
ACKR3 P25106 1/20 0.36
SCD O00767 1/20 0.36

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
SCHEMBL20367488 0.82 KDM4C (0.47) KDM4CTAS2R8KCNH2P2RY14PTGER4
SCHEMBL20162109 0.81 TAS2R8 (0.49) KDM4CTAS2R8KCNH2ABCB1
Trifluoroacetic Acid SCHEMBL20162135 0.81 KDM4C (0.46) KDM4CTAS2R8KCNH2P2RY14PTGER4
SCHEMBL20367330 0.79 ABCB1 (0.44) KDM4CTAS2R8ABCB1
SCHEMBL20367121 0.77 ABCB1 (0.44) KDM4CTAS2R8ABCB1ACKR3
SCHEMBL20330427 0.77 KDM4C (0.46) KDM4CTAS2R8CYP3A4CYP2C9
SCHEMBL20367225 0.76 KDM4C (0.48) KDM4CTAS2R8KCNH2P2RY14DRD4
SCHEMBL20162152 0.76 KDM4C (0.45) KDM4CTAS2R8KCNH2P2RY14DRD4
SCHEMBL20162181 0.76 KDM4C (0.47) KDM4CTAS2R8KCNH2P2RY14ABCB1
SCHEMBL19304326 0.75 SCD (0.59) KDM4CSCD

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-10294237-B2 Bicyclic heterocyclic amide derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-05-21 US disclosed
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 US disclosed
EP-3323809-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-05-23 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 (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-10294237-B2 Bicyclic heterocyclic amide derivative NR0B1, NR2E1, NR0B2 KDM4C 1041/4885TAS2R8 2479/4885KCNH2 2201/4885
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE NR0B1, NR2E1, NR0B2 KDM4C 1041/4885TAS2R8 2479/4885KCNH2 2201/4885

“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.