SCHEMBL4845014

SCHEMBL4845014

O=C(O)Cc1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cc(C(F)(F)F)ccc3F)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.42
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
MMP8 P22894 10/20 0.39
MMP3 P08254 5/20 0.39
RORC P51449 5/20 0.38
TRPA1 O75762 2/20 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
SCHEMBL4836741 0.93 FFAR4 (0.40) FFAR4MMP8MMP3RORCTRPA1
SCHEMBL4841606 0.93 FFAR4 (0.43) FFAR4RXRARXRBRXRGMMP8
SCHEMBL4845420 0.93 FFAR4 (0.43) FFAR4RXRARXRBRXRGMMP8
SCHEMBL4840063 0.93 RXRA (0.40) RXRARXRBRXRGMMP8MMP3
SCHEMBL4842320 0.91 RXRA (0.41) RXRARXRBRXRGMMP8MMP3
SCHEMBL4837989 0.90 PPARD (0.40) MMP8MMP3TRPA1
SCHEMBL4845085 0.90 MMP8 (0.42) MMP8MMP3
SCHEMBL4837344 0.90 RORC (0.43) MMP8MMP3RORC
SCHEMBL4837122 0.90 RORC (0.43) MMP8MMP3RORC
SCHEMBL4845199 0.88 FFAR4 (0.44) FFAR4MMP8MMP3

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 FFAR4 125/4885RXRA 1572/4885RXRB 1554/4885

“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.