SCHEMBL13633770

SCHEMBL13633770

COc1cc(NS(=O)(=O)c2cc(F)ccc2C)c2ncccc2c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 11/20 0.67
NFKBIA P25963 2/20 0.65
RELA Q04206 2/20 0.65
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
TDP1 Q9NUW8 5/20 0.65
CXCR2 P25025 2/20 0.65
LMNA P02545 1/20 0.65
TP53 P04637 1/20 0.65
MAPT P10636 1/20 0.65
HPGD P15428 1/20 0.65
TSHR P16473 1/20 0.65
AGTR1 P30556 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
POLB P06746 1/20 0.62
CXCR4 P61073 1/20 0.60
CKS1B P61024 2/20 0.57
SKP2 Q13309 2/20 0.57

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
SCHEMBL17897816 0.87 SLC40A1 (0.79) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL13633861 0.87 SLC40A1 (0.73) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL4489851 0.84 MEN1 (0.84) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL11997103 0.83 SLC40A1 (0.79) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL4489024 0.83 SLC40A1 (0.77) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL30854819 0.82 CXCR2 (0.77) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL29255671 0.82 CXCR2 (0.77) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL11973232 0.80 SLC40A1 (1.00) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL4484000 0.80 SLC40A1 (0.76) SLC40A1NFKBIARELAMEN1KMT2A
SCHEMBL11973706 0.79 SLC40A1 (0.78) SLC40A1NFKBIARELAMEN1KMT2A

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-8470821-B2 PDE4B inhibitors and uses therefor PLEXXIKON INC. (US) 2013-06-25 US disclosed
US-8470821-B2 PDE4B inhibitors and uses therefor PLEXXIKON INC. (US) 2013-06-25 US disclosed
US-20090286793-A1 PDE4B INHIBITORS AND USES THEREFOR PLEXXIKON, INC. 2009-11-19 US disclosed
US-20090286793-A1 PDE4B INHIBITORS AND USES THEREFOR PLEXXIKON, INC. 2009-11-19 US disclosed
US-7585859-B2 PDE4B inhibitors and uses therefor PLEXXIKON, INC. (US) 2009-09-08 US disclosed
US-7585859-B2 PDE4B inhibitors and uses therefor PLEXXIKON, INC. (US) 2009-09-08 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 (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-20090286793-A1 PDE4B INHIBITORS AND USES THEREFOR PDE4B, PDE7B, PDE4A SLC40A1 4638/4885NFKBIA 980/4885RELA 4160/4885

“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.