SCHEMBL5233169

SCHEMBL5233169

Cc1c(C(=O)O)sc2c(C3CCCCC3)c(-c3ccc(Cl)cc3)n(CC(=O)N3CCOCC3)c12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.45
TYMS P04818 6/20 0.45
LTA4H P09960 6/20 0.45
VDR P11473 6/20 0.45
SRC P12931 6/20 0.45
MAPK1 P28482 6/20 0.45
CTSK P43235 6/20 0.45
NOTUM Q6P988 1/20 0.38
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PIK3CA P42336 1/20 0.35
FKBP1A P62942 1/20 0.35
PTGS2 P35354 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35

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
SCHEMBL2989235 0.88 MAPK1 (0.42) EGFRTYMSLTA4HVDRSRC
SCHEMBL2995605 0.87 EGFR (0.43) EGFRTYMSLTA4HVDRSRC
SCHEMBL2992070 0.87 EGFR (0.41) EGFRTYMSLTA4HVDRSRC
SCHEMBL2990712 0.86 EGFR (0.41) EGFRTYMSLTA4HVDRSRC
SCHEMBL2994293 0.85 EGFR (0.40) EGFRTYMSLTA4HVDRSRC
SCHEMBL2995091 0.85 MAPK1 (0.41) EGFRTYMSLTA4HVDRSRC
SCHEMBL2997787 0.84 EGFR (0.40) EGFRTYMSLTA4HVDRSRC
SCHEMBL2986510 0.84 EGFR (0.39) EGFRTYMSLTA4HVDRSRC
SCHEMBL5233165 0.83 EGFR (0.48) EGFRTYMSLTA4HVDRSRC
SCHEMBL2988705 0.82 EGFR (0.39) EGFRTYMSLTA4HVDRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP claimed