SCHEMBL4844926

SCHEMBL4844926

O=C(O)Cc1ccc(CCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.42
SLC13A5 Q86YT5 1/20 0.42
MMP8 P22894 6/20 0.41
MMP3 P08254 3/20 0.41
FKBP1A P62942 4/20 0.41
S1PR5 Q9H228 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL4842554 0.95 RORC (0.43) RORCSLC13A5MMP8MMP3FKBP1A
SCHEMBL4840675 0.92 FKBP1A (0.40) RORCSLC13A5MMP8MMP3FKBP1A
SCHEMBL4842623 0.91 BACE1 (0.47) RORCMMP8MMP3S1PR5BACE1
SCHEMBL4842475 0.91 BACE1 (0.47) RORCMMP8MMP3S1PR5BACE1
SCHEMBL4834178 0.91 BACE1 (0.47) RORCMMP8MMP3S1PR5BACE1
SCHEMBL4845363 0.90 RORC (0.43) RORCMMP8MMP3
SCHEMBL4841476 0.90 BACE1 (0.46) RORCMMP8MMP3S1PR5BACE1
Potassium SCHEMBL4841487 0.90 BACE1 (0.46) RORCMMP8MMP3S1PR5BACE1
SCHEMBL4834162 0.90 BACE1 (0.46) RORCMMP8MMP3S1PR5BACE1
SCHEMBL4842556 0.89 RORC (0.43) RORCSLC13A5MMP8MMP3FKBP1A

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 1777/4885SLC13A5 3026/4885MMP8 3968/4885

“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.