SCHEMBL7937331

SCHEMBL7937331

CC1(C)COC(c2cc(C(F)(F)F)ccc2-c2ccccc2)=N1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.42
KDM4E B2RXH2 1/20 0.41
FABP5 Q01469 1/20 0.41
CHRM1 P11229 2/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
IL2 P60568 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
SCHEMBL7513299 0.85 KDM4E (0.44) KDM4ELMNAMAPTHTTHRH3
SCHEMBL7842188 0.82 KDM4E (0.43) KDM4ELMNAMAPTHTTIL2
SCHEMBL7934334 0.81 KDM4E (0.45) KDM4ECHRM1LMNAMAPTHTT
SCHEMBL9119960 0.81 KDM4E (0.39) KDM4ELMNAMAPTHTTHRH3
SCHEMBL7112634 0.80 KDM4E (0.53) KDM4ELMNAMAPTHTTHRH3
SCHEMBL9607357 0.80 KDM4E (0.41) KDM4ELMNAMAPTHTT
SCHEMBL20921262 0.80 KDM4E (0.41) KDM4ELMNAMAPTHTTIL2
SCHEMBL425368 0.78 KDM4E (0.39) KDM4ELMNAMAPTHTT
SCHEMBL422793 0.78 KDM4E (0.39) KDM4ELMNAMAPTHTT
SCHEMBL10835648 0.78 KDM4E (0.50) KDM4ELMNAMAPTHTTHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010020110-A1 Production methods of alpha, alpha, alpha-trifluoromethylphenyl-substituted benzoic acid and intermediate therefor SUMIKA FINE CHEMICALS CO., LTD. (JP) 2001-09-06 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-20010020110-A1 Production methods of alpha, alpha, alpha-trifluoromethylphenyl-substituted benzoic acid and intermediate therefor SLC6A11, CYP4F11, SLC39A11 FABP4 2657/4885KDM4E 3088/4885FABP5 3203/4885

“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.