SCHEMBL8798606

SCHEMBL8798606

COCOc1c(NC(=O)NCCC(=O)N(CCO[Si](C)(C)C(C)(C)C)CCO[Si](C)(C)C(C)(C)C)cc(OC)cc1C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
LMNA P02545 1/20 0.31
LPAR1 Q92633 1/20 0.31

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
SCHEMBL8801653 0.87 LPAR1 (0.34) ALOX5PTGS1PTGS2LMNALPAR1
SCHEMBL8798615 0.78 LPAR1 (0.30) LPAR1
SCHEMBL8798603 0.74 LPAR1 (0.32) LPAR1
SCHEMBL8798461 0.73 CA1 (0.41) LMNALPAR1
SCHEMBL8702761 0.73 LPAR1 (0.39) LPAR1
SCHEMBL8703601 0.69 MAPK14 (0.47) LMNALPAR1
SCHEMBL8798636 0.69 KDM4E (0.51)
SCHEMBL8804341 0.67 LMNA (0.34) LMNA
SCHEMBL8798530 0.67 SMN1; SMN2 (0.31)
SCHEMBL8798554 0.65 SMN1; SMN2 (0.33)

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-0790240-A1 Phenol-derivatives having pharmaceutical activity and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1997-08-20 EP disclosed