SCHEMBL6700570

SCHEMBL6700570

Cc1cnc2ccc(F)c(Cl)c2c1O

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
AXL P30530 1/20 0.30
PRKCI P41743 1/20 0.30
TNF P01375 1/20 0.30
MET P08581 1/20 0.30
TGFBR1 P36897 1/20 0.30
BRAF P15056 1/20 0.30

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
SCHEMBL22304289 0.80 IDO1 (0.34) ALDH1A1AXLPRKCIMETTGFBR1
SCHEMBL17278413 0.78 TNF (0.36) TNF
SCHEMBL13577864 0.74 SMN1; SMN2 (0.35) ALDH1A1CYP3A4AXLMETTGFBR1
SCHEMBL2822958 0.73 KDM4E (0.35) ALDH1A1
SCHEMBL2826725 0.69 FABP3 (0.33)
SCHEMBL15840579 0.68 TNF (0.36) TNF
SCHEMBL12886366 0.68 ALDH1A1 (0.40) ALDH1A1CYP3A4PTGS1PTGS2TNF
Ethane SCHEMBL6695707 0.66 MAPT (0.37) ALDH1A1CYP3A4PTGS2
SCHEMBL18509297 0.66 PTGS1 (0.41) PTGS1PTGS2
SCHEMBL12810046 0.66 ALDH1A1 (0.55) ALDH1A1CYP3A4

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-20040077602-A1 Mixture composition for controlling ectoparasites MEIJI SEIKA KAISHA, LTD. (JP) 2004-04-22 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-20040077602-A1 Mixture composition for controlling ectoparasites SF3A3, PEX3, HCN3 ALDH1A1 3278/4885CYP3A4 329/4885PTGS1 4782/4885

“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.