SCHEMBL3973365

SCHEMBL3973365

Nc1ccc(CC(=O)NS(=O)(=O)c2ccccc2F)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.55
ERBB2 P04626 13/20 0.55
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GBA1 P04062 1/20 0.44
KAT6A Q92794 2/20 0.43
CNR2 P34972 1/20 0.43
P4HTM Q9NXG6 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL3973361 0.86 EGFR (0.52) EGFRERBB2MEN1KMT2AGBA1
SCHEMBL3969838 0.83 CA1 (0.50) EGFRERBB2CNR2P4HTMCA1
SCHEMBL3974013 0.83 EGFR (0.48) EGFRERBB2MEN1KMT2AKAT6A
SCHEMBL3975407 0.80 EGFR (0.73) EGFRERBB2MEN1KMT2AP4HTM
SCHEMBL6851854 0.79 GBA1 (0.54) MEN1KMT2AGBA1KAT6ACA1
SCHEMBL16739378 0.74 MEN1 (0.55) MEN1KMT2AGBA1KAT6A
SCHEMBL29489599 0.74 MEN1 (0.55) MEN1KMT2AGBA1KAT6A
SCHEMBL3975864 0.72 CNR2 (0.52) EGFRERBB2MEN1KMT2ACNR2
SCHEMBL3972183 0.72 EGFR (0.63) EGFRERBB2
SCHEMBL21887555 0.72 PDE4B (0.46) EGFRERBB2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569602-B2 Furan derivatives as EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2009-08-04 US disclosed
EP-1673360-B1 FURAN DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ASTERAND UK LTD (GB) 2008-12-17 EP disclosed
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2008-12-11 US disclosed
US-7417068-B2 EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2008-08-26 US disclosed
US-20050124676-A1 EP4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2005-06-09 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 (2 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-20050124676-A1 EP4 receptor antagonists PTGER4, PTGER3, NR4A3 EGFR 433/4885ERBB2 854/4885MEN1 1691/4885
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER3, NR4A3 EGFR 433/4885ERBB2 854/4885MEN1 1691/4885

“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.