SCHEMBL17909934

SCHEMBL17909934

O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3C3CC3)c3cccc(F)c32)c(F)c1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.80
CYP2C9 P11712 9/20 0.80
CYP3A4 P08684 6/20 0.80
CYP2C19 P33261 2/20 0.80

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
SCHEMBL16797183 0.90 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL17909918 0.83 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL16797181 0.78 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL17909920 0.77 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL19471662 0.77 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL18268162 0.76 RORC (0.75) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL17909917 0.76 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL16797179 0.76 RORC (0.74) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL16797196 0.75 RORC (1.00) RORCCYP2C9CYP3A4CYP2C19
SCHEMBL16797221 0.74 RORC (0.71) RORCCYP2C9CYP3A4CYP2C19

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9861612-B2 Indolyl-containing RORγt inhibitors ORCA PHARMACEUTICALS LIMITED (GB) 2018-01-09 US claimed
US-20170050928-A1 Compounds ORCA PHARMACEUTICALS, LLC 2017-02-23 US claimed
US-9861612-B2 Indolyl-containing RORγt inhibitors ORCA PHARMACEUTICALS LIMITED (GB) 2018-01-09 US disclosed
US-9861612-B2 Indolyl-containing RORγt inhibitors ORCA PHARMACEUTICALS LIMITED (GB) 2018-01-09 US disclosed
US-20170050928-A1 Compounds ORCA PHARMACEUTICALS, LLC 2017-02-23 US disclosed
US-20170050928-A1 Compounds ORCA PHARMACEUTICALS, LLC 2017-02-23 US disclosed
US-20170050928-A1 Compounds ORCA PHARMACEUTICALS, LLC 2017-02-23 US disclosed
US-9522134-B2 Compounds ORCA PHARMACEUTICALS LIMITED (GB) 2016-12-20 US disclosed
US-9522134-B2 Compounds ORCA PHARMACEUTICALS LIMITED (GB) 2016-12-20 US disclosed
US-9522134-B2 Compounds ORCA PHARMACEUTICALS LIMITED (GB) 2016-12-20 US disclosed
US-20160199348-A1 Compounds ORCA PHARMACEUTICALS LIMITED 2016-07-14 US disclosed
US-20160199348-A1 Compounds ORCA PHARMACEUTICALS LIMITED 2016-07-14 US disclosed
US-20160199348-A1 Compounds ORCA PHARMACEUTICALS LIMITED 2016-07-14 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 (2 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-20170050928-A1 Compounds RORC, RORB, RORA RORC 1/4885CYP2C9 184/4885CYP3A4 151/4885
US-20160199348-A1 Compounds RORC, RORB, RORA RORC 1/4885CYP2C9 398/4885CYP3A4 181/4885

“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.