SCHEMBL20120048

SCHEMBL20120048

CC(C(=O)Nc1ccc(C(F)(F)F)cc1)n1nc(-c2cccs2)ccc1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.53
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 7/20 0.46
MAPT P10636 5/20 0.46
RXFP1 Q9HBX9 1/20 0.46
KDM4E B2RXH2 1/20 0.42
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 2/20 0.39
THRB P10828 1/20 0.39
PPARG P37231 1/20 0.39
NR2E3 Q9Y5X4 1/20 0.39
NCOR2 Q9Y618 1/20 0.39

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
SCHEMBL20120050 0.87 TP53 (0.51) TP53MEN1KMT2APOLBMAPT
SCHEMBL20113811 0.85 TP53 (0.64) TP53POLBMAPTKDM4ELMNA
SCHEMBL20120159 0.85 TP53 (0.49) TP53MEN1KMT2APOLBMAPT
SCHEMBL20120053 0.84 TP53 (0.47) TP53MEN1KMT2APOLBMAPT
SCHEMBL20113814 0.84 TP53 (0.73) TP53MEN1KMT2APOLBMAPT
SCHEMBL20120154 0.83 TP53 (0.48) TP53MEN1KMT2APOLBMAPT
SCHEMBL20120131 0.83 TP53 (0.50) TP53MEN1KMT2APOLBMAPT
SCHEMBL20120057 0.83 TP53 (0.54) TP53POLBMAPTLMNATDP1
SCHEMBL20120157 0.83 MAPT (0.47) TP53POLBMAPTLMNA
SCHEMBL20113815 0.82 TP53 (0.60) TP53POLBMAPTKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190248779-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2019-08-15 US disclosed
US-20190248779-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2019-08-15 US disclosed
WO-2018081378-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2018-05-03 WO 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-20190248779-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY CFTR, SCNN1B, SCNN1G TP53 1387/4885MEN1 4112/4885KMT2A 4756/4885

“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.