SCHEMBL19459338

SCHEMBL19459338

CC(=O)NC(Cc1ccc(NO)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
ITGB3 P05106 2/20 0.54
ITGA2B P08514 2/20 0.54
ITGB1 P05556 2/20 0.52
ITGA4 P13612 1/20 0.52
ITGAV P06756 1/20 0.51
ITGB5 P18084 1/20 0.51
FOLH1 Q04609 2/20 0.49
GNPAT O15228 1/20 0.48
MME P08473 2/20 0.48
ACE P12821 2/20 0.48
ACE2 Q9BYF1 2/20 0.48
CPA1 P15085 1/20 0.48
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
PAM P19021 1/20 0.48
FPR2 P25090 5/20 0.47
TACR1 P25103 1/20 0.47

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
SCHEMBL19459336 1.00 LMNA (0.58) LMNAITGB3ITGA2BITGB1ITGA4
SCHEMBL2777992 0.87 LMNA (0.58) LMNAITGB3ITGA2BITGB1ITGA4
SCHEMBL6776761 0.87 LMNA (0.58) LMNAITGB3ITGA2BITGB1ITGA4
SCHEMBL15498955 0.84 TACR1 (0.51) TACR1
SCHEMBL19483164 0.84 TACR1 (0.51) TACR1
SCHEMBL5061764 0.83 LMNA (0.61) LMNAITGB3ITGA2BITGB1ITGA4
SCHEMBL11122115 0.83 LMNA (0.61) LMNAITGB3ITGA2BITGB1ITGA4
Acetyl Tyrosine SCHEMBL8977601 0.83 FOLH1 (0.66) LMNAITGB3ITGA2BFOLH1MME
Acetyl Tyrosine SCHEMBL313539 0.83 FOLH1 (0.66) LMNAITGB3ITGA2BFOLH1MME
Acetyl Tyrosine SCHEMBL8977600 0.83 FOLH1 (0.66) LMNAITGB3ITGA2BFOLH1MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11724982-B2 Trifluoromethoxylation of arenes via intramolecular trifluoromethoxy group migration THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-08-15 US disclosed
US-20200262784-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2020-08-20 US disclosed
US-10676424-B2 Trifluoromethoylation of arenes via intramolecular trifluoromethoxy group migration THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2020-06-09 US disclosed
US-20190016670-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2019-01-17 US disclosed
US-10118890-B2 Trifluoromethoxylation of arenes via intramolecular trifluoromethoxy group migration THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2018-11-06 US disclosed
US-20170298008-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-10-19 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 (6 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-20190016670-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION AHR, ARSA, ALK LMNA 1816/4885ITGB3 1794/4885ITGA2B 3702/4885
US-10118890-B2 Trifluoromethoxylation of arenes via intramolecular trifluoromethoxy group migration AHR, ARSA, ALK LMNA 1806/4885ITGB3 1813/4885ITGA2B 3710/4885
US-20170298008-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION AHR, ARSA, ALK LMNA 1772/4885ITGB3 1959/4885ITGA2B 3899/4885
US-20200262784-A1 TRIFLUOROMETHOXYLATION OF ARENES VIA INTRAMOLECULAR TRIFLUOROMETHOXY GROUP MIGRATION AHR, AFF2, AFF4 LMNA 1773/4885ITGB3 1551/4885ITGA2B 3462/4885
US-11724982-B2 Trifluoromethoxylation of arenes via intramolecular trifluoromethoxy group migration AHR, AFF2, AFF4 LMNA 1773/4885ITGB3 1551/4885ITGA2B 3462/4885
US-10676424-B2 Trifluoromethoylation of arenes via intramolecular trifluoromethoxy group migration AHR, AFF2, AFF4 LMNA 1993/4885ITGB3 2236/4885ITGA2B 3881/4885

“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.