SCHEMBL4843231

SCHEMBL4843231

COC(=O)C1(c2ccc(OCCNC(=O)[C@@H]3Cc4ccccc4N3S(=O)(=O)c3ccc(-c4cc(C(F)(F)F)ccc4Cl)cc3)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.39
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
TRPA1 O75762 3/20 0.35
MMP8 P22894 4/20 0.35
MMP3 P08254 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
RORC P51449 2/20 0.34
POLB P06746 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
GPR119 Q8TDV5 2/20 0.34
MAPT P10636 1/20 0.34
GNRHR P30968 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL4841959 0.94 FFAR4 (0.41) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4842917 0.88 FFAR4 (0.41) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4837553 0.88 FFAR4 (0.40) FFAR4ALDH1A1NPSR1MMP8MMP3
SCHEMBL4843247 0.88 FFAR4 (0.40) FFAR4ALDH1A1NPSR1MMP8MMP3
SCHEMBL4837997 0.88 FFAR4 (0.43) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4832552 0.88 FFAR4 (0.44) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4844640 0.87 FFAR4 (0.39) FFAR4ALDH1A1NPSR1MMP8MMP3
SCHEMBL4840740 0.86 FFAR4 (0.39) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4833426 0.86 FFAR4 (0.40) FFAR4ALDH1A1NPSR1TRPA1MMP8
SCHEMBL4841606 0.86 FFAR4 (0.43) FFAR4ALDH1A1NPSR1MMP8MMP3

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 125/4885ALDH1A1 1819/4885NPSR1 101/4885

“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.