SCHEMBL4843261

SCHEMBL4843261

O=C(O)CCCOc1ccc(CNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 13/20 0.44
FAAH O00519 1/20 0.40
ADAMTS4 O75173 1/20 0.39
MMP13 P45452 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MMP1 P03956 1/20 0.39
ADAM17 P78536 1/20 0.39
TRPA1 O75762 1/20 0.39
BACE1 P56817 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
SCHEMBL4837563 0.98 RORC (0.44) RORCFAAHADAMTS4MMP13ADAMTS5
SCHEMBL4842189 0.96 RORC (0.43) RORCADAMTS4MMP13ADAMTS5MMP1
SCHEMBL4841550 0.94 RORC (0.44) RORCTRPA1
SCHEMBL4843069 0.93 RORC (0.43) RORCADAMTS4MMP13ADAMTS5FFAR1
SCHEMBL4843218 0.93 FAAH (0.41) RORCFAAHADAMTS4MMP13ADAMTS5
SCHEMBL4841332 0.92 RORC (0.43) RORCTRPA1
SCHEMBL4833865 0.91 RORC (0.42) RORCFFAR1TRPA1BACE1
SCHEMBL4840183 0.91 FAAH (0.40) RORCFAAHADAMTS4MMP13ADAMTS5
SCHEMBL4842754 0.90 RORC (0.44) RORCTRPA1
SCHEMBL4843350 0.90 RORC (0.43) RORCFFAR1FFAR4TRPA1BACE1

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-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 RORC 1777/4885FAAH 2327/4885ADAMTS4 4468/4885

“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.