SCHEMBL26202011

SCHEMBL26202011

CC(C)c1cnc(-c2ccc(C(F)(F)F)cc2)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 4/20 0.55
TRPV1 Q8NER1 1/20 0.54
COMT P21964 1/20 0.54
NPY5R Q15761 1/20 0.47
DGAT1 O75907 1/20 0.42
GFER P55789 1/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
ATM Q13315 1/20 0.41
KDM5B Q9UGL1 1/20 0.40
KIF11 P52732 1/20 0.39
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
WNT3A P56704 1/20 0.38
NPBWR1 P48145 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
KDM1A O60341 1/20 0.38

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
SCHEMBL23736196 0.78 SCN2A (0.59) SCN2ATRPV1COMTNPY5RGFER
SCHEMBL25579108 0.78 SCN2A (0.55) SCN2ANPY5RDGAT1KDM1A
SCHEMBL15331905 0.71 COMT (0.57) SCN2ATRPV1COMTNPY5RGFER
SCHEMBL5833712 0.71 COMT (0.65) SCN2ATRPV1COMTNPY5RRAB9A
SCHEMBL2433653 0.70 COMT (1.00) SCN2ATRPV1COMTNPY5RTNKS
SCHEMBL26625383 0.70 SCN2A (0.69) SCN2ATRPV1COMTNPY5RDGAT1
SCHEMBL7012072 0.70 RECQL (0.67) SCN2ATRPV1COMTNPY5RRAB9A
SCHEMBL12740574 0.70 HTT (0.33) KDM4EPOLBKDM1A
SCHEMBL2609357 0.68 KIF11 (0.47) SCN2AKDM4EKDM5BKIF11NPBWR1
SCHEMBL30406459 0.67 SCN2A (0.60) SCN2ATRPV1COMTNPY5RRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271941-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-31 US disclosed
US-20230271941-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-31 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 (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-20230271941-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 SCN2A 1341/4885TRPV1 631/4885COMT 3605/4885

“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.