SCHEMBL4841399

SCHEMBL4841399

COc1cccc2c1CC(C(=O)NCCOc1ccc(CC(=O)O)cc1)N2S(=O)(=O)c1ccc(-c2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 10/20 0.41
ADAMTS4 O75173 1/20 0.39
MMP13 P45452 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
RXRA P19793 3/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
MMP1 P03956 1/20 0.37
ADAM17 P78536 1/20 0.37
PPARD Q03181 2/20 0.37
PLAU P00749 1/20 0.36
PLAT P00750 1/20 0.36
NPC1 O15118 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
SCHEMBL4842585 0.95 RORC (0.38) RORCADAMTS4MMP13ADAMTS5HCRTR1
SCHEMBL4839181 0.90 BACE1 (0.43) RORCRXRARXRBRXRGNPC1
SCHEMBL4837344 0.88 RORC (0.43) RORCADAMTS4MMP13ADAMTS5MMP1
SCHEMBL4837122 0.88 RORC (0.43) RORCADAMTS4MMP13ADAMTS5MMP1
SCHEMBL4840659 0.85 BACE1 (0.43) RORCHCRTR1HCRTR2NPC1
SCHEMBL4841159 0.85 RORC (0.40) RORC
SCHEMBL4841819 0.84 RORC (0.41) RORCADAMTS4MMP13ADAMTS5HCRTR1
SCHEMBL4833611 0.84 RORC (0.44) RORCADAMTS4MMP13ADAMTS5
SCHEMBL4842320 0.83 RXRA (0.41) RORCRXRARXRBRXRG
SCHEMBL4841876 0.82 RORC (0.39) RORCADAMTS4MMP13ADAMTS5MMP1

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 1777/4885ADAMTS4 4468/4885MMP13 4342/4885

“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.