SCHEMBL18151832

SCHEMBL18151832

COc1cc(C(O)(C(F)(F)F)C(F)(F)F)ccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 15/20 0.54
ALDH1A1 P00352 3/20 0.46
CYP2D6 P10635 3/20 0.46
KCNH2 Q12809 2/20 0.46
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL18156939 0.92 RORC (0.46) RORCALDH1A1CYP2D6KCNH2MAPT
SCHEMBL16799617 0.89 RORC (0.57) RORCCYP2D6KCNH2
SCHEMBL18275234 0.88 RORC (0.43) RORCALDH1A1CYP2D6KCNH2MAPT
SCHEMBL18151182 0.87 RORC (0.57) RORCCYP2D6KCNH2CA12CA1
SCHEMBL18151844 0.87 RORC (0.53) RORCCYP2D6KCNH2CA12CA1
SCHEMBL18151211 0.87 RORC (0.53) RORCCYP2D6KCNH2CA12CA1
SCHEMBL18151203 0.82 RORC (0.53) RORCMEN1KMT2A
SCHEMBL16799959 0.82 RORC (0.76) RORCCYP2D6KCNH2
SCHEMBL18156929 0.81 RORC (0.48) RORCCYP2D6KCNH2L3MBTL1
SCHEMBL18156932 0.80 RORC (0.51) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3077372-B1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING BV (NL) 2019-02-06 EP claimed
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US claimed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 US claimed
EP-3077372-B1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING BV (NL) 2019-02-06 EP disclosed
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 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-20160304448-A1 ROR GAMMA (RORy) MODULATORS RORC, RORA, RORB RORC 1/4885ALDH1A1 1054/4885CYP2D6 645/4885

“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.