SCHEMBL4844796

SCHEMBL4844796

CC(C)(C)OC(=O)CCc1ccc(CCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.39
RORC P51449 6/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
FKBP1A P62942 1/20 0.37
POLB P06746 1/20 0.37
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
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HDAC8 Q9BY41 1/20 0.37

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 0.94 PTPN1 (0.39) PTPN1RORCCA12CA1CA2
SCHEMBL4842798 0.91 PTPN1 (0.39) PTPN1RORCPSEN1PSEN2APH1B
SCHEMBL4842556 0.90 RORC (0.43) RORCCA12CA1CA2CA9
SCHEMBL4837568 0.90 RORC (0.39) PTPN1RORCHDAC8
SCHEMBL4833368 0.89 RORC (0.38) PTPN1RORCHDAC8
SCHEMBL4839795 0.88 TRPA1 (0.40) RORC
SCHEMBL4842635 0.88 RORC (0.42) RORCCA12CA1CA2CA9
SCHEMBL4842554 0.88 RORC (0.43) RORCCA12CA1CA2CA9
SCHEMBL4891032 0.87 POLB (0.40) RORCPOLBMEN1KMT2A
SCHEMBL4211574 0.87 MMP8 (0.41) RORCCA12CA1CA2CA9

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 1777/4885CA12 4875/4885

“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.