SCHEMBL16477696

SCHEMBL16477696

CC(C)(C)NS(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.66
CA2 P00918 1/20 0.66
MMP1 P03956 1/20 0.66
MMP2 P08253 1/20 0.66
MMP9 P14780 1/20 0.66
MMP8 P22894 1/20 0.66
MMP13 P45452 1/20 0.66
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
LMNA P02545 2/20 0.65
KDM4E B2RXH2 1/20 0.65
NPC1 O15118 1/20 0.65
MAPT P10636 1/20 0.65
HPGD P15428 1/20 0.65
RAB9A P51151 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
NPSR1 Q6W5P4 2/20 0.55
HSD17B2 P37059 1/20 0.53
TSHR P16473 1/20 0.52
NR3C1 P04150 1/20 0.51

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
SCHEMBL14677195 0.83 CA1 (0.61) CA1CA2MMP1MMP2MMP9
SCHEMBL5184452 0.83 CA1 (0.70) CA1CA2MMP1MMP2MMP9
SCHEMBL29537299 0.82 CA1 (0.74) CA1CA2MMP1MMP2MMP9
SCHEMBL29213152 0.82 SMN1; SMN2 (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL24429468 0.82 CA1 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL22489824 0.81 CA1 (0.55) CA1CA2MMP1MMP2MMP9
SCHEMBL30855790 0.79 KMT2A (0.69) MEN1KMT2ALMNAKDM4ENPC1
SCHEMBL8229584 0.79 CA1 (1.00) CA1CA2MMP1MMP2MMP9
SCHEMBL26387452 0.79 KMT2A (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL421918 0.79 CA1 (0.70) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903015-A Process for the preparation of N-fluoro-N-alkylsulfonamides 中国科学院上海有机化学研究所 2024-04-19 CN claimed
CN-117903015-A Process for the preparation of N-fluoro-N-alkylsulfonamides 中国科学院上海有机化学研究所 2024-04-19 CN disclosed
US-20220153734-A1 Pyrazolopyridine Compounds For IRE1 Inhibition Optikira, LLC 2022-05-19 US disclosed
US-9216950-B2 Agonists of Src homology-2 containing protein tyrosine phosphatase-1 and treatment methods using the same NATIONAL TAIWAN UNIVERSITY (TW) 2015-12-22 US disclosed
US-9090617-B1 Agonists of Src homology-2 containing protein tyrosine phosphatase-1 and treatment methods using the same NATIONAL TAIWAN UNIVERSITY (TW) 2015-07-28 US disclosed
US-20150191467-A1 AGONISTS OF SRC HOMOLOGY-2 CONTAINING PROTEIN TYROSINE PHOSPHATASE-1 AND TREATMENT METHODS USING THE SAME RAND BIOSCIENCES (KR) 2015-07-09 US disclosed
US-20140200239-A1 AGONISTS OF SRC HOMOLOGY-2 CONTAINING PROTEIN TYROSINE PHOSPHATASE-1 AND TREATMENT METHODS USING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2014-07-17 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 (3 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-20150191467-A1 AGONISTS OF SRC HOMOLOGY-2 CONTAINING PROTEIN TYROSINE PHOSPHATASE-1 AND TREATMENT METHODS USING THE SAME SRC, PTPRCAP, GRB2 CA1 4245/4885CA2 2014/4885MMP1 4394/4885
US-20140200239-A1 AGONISTS OF SRC HOMOLOGY-2 CONTAINING PROTEIN TYROSINE PHOSPHATASE-1 AND TREATMENT METHODS USING THE SAME SRC, PTPRCAP, GRB2 CA1 4245/4885CA2 2014/4885MMP1 4394/4885
US-20220153734-A1 Pyrazolopyridine Compounds For IRE1 Inhibition XBP1, ERN1, ERN2 CA1 4705/4885CA2 4235/4885MMP1 2519/4885

“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.