SCHEMBL21073145

SCHEMBL21073145

O=C1COc2ccc(S(=O)(=O)Nc3ccc(-c4ccc(C(O)(C(F)(F)F)C(F)(F)F)cc4F)cc3)cc2N1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PKM P14618 6/20 0.55
LMNA P02545 1/20 0.55
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RORC P51449 9/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48

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
SCHEMBL21072961 0.84 RORC (0.50) PKMRORC
SCHEMBL21073502 0.84 RORC (0.51) RORC
SCHEMBL21072988 0.83 RORC (0.52) PKMRORC
SCHEMBL21073503 0.83 PKM (0.62) PKMRORC
SCHEMBL21072889 0.83 MAPT (0.63) MEN1KMT2ARORC
SCHEMBL21787473 0.82 RORC (0.42) RORC
SCHEMBL21073134 0.81 RORC (0.52) RORC
SCHEMBL21072887 0.81 RORC (0.51) RORC
SCHEMBL21073154 0.80 RORC (0.51) PKMRORC
SCHEMBL21073158 0.78 RORC (0.63) RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210161837-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-06-03 US disclosed
US-20210161837-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-06-03 US disclosed
US-20190192454-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-06-27 US disclosed
US-20190192454-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-06-27 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-20190192454-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS RORA, RORB, RORC PKM 3347/4885LMNA 3433/4885MEN1 2278/4885
US-20210161837-A1 METHODS FOR TREATING CANCER WITH RORGAMMA INHIBITORS RORA, RORB, RORC PKM 3347/4885LMNA 3433/4885MEN1 2278/4885

“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.