SCHEMBL4842798

SCHEMBL4842798

CC(C)(C)OC(=O)Cc1cccc(CCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.39
RORC P51449 7/20 0.38
MMP8 P22894 5/20 0.38
MMP3 P08254 3/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
HDAC8 Q9BY41 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
SCHEMBL4833738 0.95 PTPN1 (0.39) PTPN1RORCMMP8MMP3
SCHEMBL4844796 0.91 PTPN1 (0.39) PTPN1RORCPSEN1PSEN2APH1B
SCHEMBL4845363 0.91 RORC (0.43) RORCMMP8MMP3PSEN1PSEN2
SCHEMBL4837568 0.89 RORC (0.39) PTPN1RORCHDAC8
SCHEMBL4838060 0.89 PTPN1 (0.39) PTPN1RORCMMP8MMP3PSEN1
SCHEMBL4833368 0.89 RORC (0.38) PTPN1RORCHDAC8
SCHEMBL4841876 0.88 RORC (0.39) RORCMMP8MMP3
SCHEMBL4837253 0.87 RORC (0.41) RORCMMP8PSEN1PSEN2APH1B
SCHEMBL4841652 0.87 NPC1 (0.41) RORCMMP8MMP3
SCHEMBL4845228 0.86 RORC (0.41) RORCMMP8MMP3PSEN1PSEN2

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 PTPN1 1931/4885RORC 1777/4885MMP8 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.