SCHEMBL19063073

SCHEMBL19063073

CCCCC(C)(CCC)C(=O)C1(C(F)(F)F)CCC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.31
RIPK1 Q13546 1/20 0.31
FAAH O00519 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
SCHEMBL19063261 0.87 RIPK1 (0.32) RIPK1
SCHEMBL18745664 0.80 RIPK1 (0.33) RIPK1
SCHEMBL18745690 0.73 RIPK1 (0.35) RIPK1
SCHEMBL13086721 0.72 DGAT1 (0.39) RIPK1
SCHEMBL28966034 0.67 CES2 (0.39) CES2FAAH
SCHEMBL2203426 0.66 TSHR (0.42)
SCHEMBL18745663 0.65 DGAT1 (0.41) RIPK1
SCHEMBL23968802 0.65 MEN1 (0.36)
SCHEMBL19685191 0.64 LMNA (0.41) CES2FAAH
SCHEMBL19509954 0.64 DGAT1 (0.38) CES2FAAH

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-10201546-B2 Quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2019-02-12 US disclosed
US-20170182056-A1 QUINOLINYL MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2017-06-29 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-10201546-B2 Quinolinyl modulators of RORγt RORC, RORB, RORA CES2 4208/4885RIPK1 1762/4885FAAH 2263/4885
US-20170182056-A1 QUINOLINYL MODULATORS OF RORyt RORC, RORA, RORB CES2 4144/4885RIPK1 1415/4885FAAH 2744/4885

“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.