SCHEMBL18939754

SCHEMBL18939754

CC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 1.00
CYP2D6 P10635 11/20 1.00
IL17A Q16552 1/20 1.00
KCNH2 Q12809 4/20 0.83

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
SCHEMBL18940001 1.00 RORC (1.00) RORCCYP2D6IL17AKCNH2
SCHEMBL18939918 1.00 RORC (1.00) RORCCYP2D6IL17AKCNH2
SCHEMBL29525641 1.00 RORC (1.00) RORCCYP2D6IL17AKCNH2
SCHEMBL24031278 0.97 RORC (0.95) RORCCYP2D6IL17AKCNH2
SCHEMBL18939838 0.93 RORC (0.86) RORCCYP2D6IL17AKCNH2
SCHEMBL29758688 0.92 RORC (1.00) RORCCYP2D6IL17AKCNH2
SCHEMBL18939922 0.92 RORC (1.00) RORCCYP2D6IL17AKCNH2
SCHEMBL18961548 0.92 RORC (0.84) RORCCYP2D6IL17AKCNH2
SCHEMBL18961492 0.92 RORC (0.84) RORCCYP2D6IL17AKCNH2
SCHEMBL18940147 0.91 RORC (1.00) RORCCYP2D6IL17AKCNH2

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3390396-B1 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2022-07-06 EP claimed
CN-109071516-B Novel compounds 阿斯利康(瑞典)有限公司 2021-08-31 CN claimed
US-10988445-B2 Compounds ASTRAZENECA AB (SE) 2021-04-27 US claimed
US-20200181084-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2020-06-11 US claimed
US-10526286-B2 Compounds ASTRAZENECA AB (SE) 2020-01-07 US claimed
US-20190084934-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2019-03-21 US claimed
US-10011566-B2 Compounds ASTRAZENECA AB (SE) 2018-07-03 US claimed
US-20170166527-A1 Novel Compounds ASTRAZENECA AB (SE) 2017-06-15 US claimed
US-20230192620-A1 ANILINE COMPOUND USED AS RORy REGULATOR SHANGHAI LITEDD CO., LTD. (CN) 2023-06-22 US disclosed
US-20230192620-A1 ANILINE COMPOUND USED AS RORy REGULATOR SHANGHAI LITEDD CO., LTD. (CN) 2023-06-22 US disclosed
US-11453644-B1 Compounds ASTRAZENECA, AB (SE) 2022-09-27 US disclosed
EP-3390396-B1 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2022-07-06 EP disclosed
EP-3390396-B1 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2022-07-06 EP disclosed
US-20220202811-A1 TREATMENT FOR RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR Ɣ (RORƔ)-DEPENDENT CANCERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-06-30 US disclosed
US-10011566-B2 Compounds ASTRAZENECA AB (SE) 2018-07-03 US disclosed
US-10011566-B2 Compounds ASTRAZENECA AB (SE) 2018-07-03 US disclosed
WO-2017102784-A9 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2018-04-05 WO disclosed
WO-2017102784-A1 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2017-06-22 WO disclosed
US-20170166527-A1 Novel Compounds ASTRAZENECA AB (SE) 2017-06-15 US disclosed
US-20170166527-A1 Novel Compounds ASTRAZENECA AB (SE) 2017-06-15 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 (9 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-11453644-B1 Compounds RORC, RORB, RORA RORC 1/4885CYP2D6 362/4885IL17A 13/4885
US-10526286-B2 Compounds RORC, RORB, RORA RORC 1/4885CYP2D6 362/4885IL17A 13/4885
US-10988445-B2 Compounds RORC, RORB, RORA RORC 1/4885CYP2D6 362/4885IL17A 13/4885
US-20230192620-A1 ANILINE COMPOUND USED AS RORy REGULATOR RORB, RORA, RORC RORC 3/4885CYP2D6 404/4885IL17A 332/4885
US-10011566-B2 Compounds RORC, RORB, RORA RORC 1/4885CYP2D6 362/4885IL17A 13/4885
US-20200181084-A1 NOVEL COMPOUNDS RORC, RORB, RORA RORC 1/4885CYP2D6 605/4885IL17A 17/4885
US-20190084934-A1 NOVEL COMPOUNDS RORC, RORB, RORA RORC 1/4885CYP2D6 605/4885IL17A 17/4885
US-20170166527-A1 Novel Compounds RORC, RORB, RORA RORC 1/4885CYP2D6 605/4885IL17A 17/4885
US-20220202811-A1 TREATMENT FOR RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR Ɣ (RORƔ)-DEPENDENT CANCERS RORA, RORB, RORC RORC 3/4885CYP2D6 3300/4885IL17A 1734/4885

“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.