SCHEMBL7949604

SCHEMBL7949604

CCc1ccc(OP(O)F)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.38
TRPA1 O75762 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALPL P05186 1/20 0.32

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
SCHEMBL7949603 0.87 HSPA5 (0.37) HSPA5TRPA1PTGDR2ALPL
SCHEMBL7951322 0.85 S1PR1 (0.39)
SCHEMBL7949607 0.85 HSPA5 (0.36) HSPA5TRPA1PTGDR2KMT2A
SCHEMBL29789565 0.79 APEX1 (0.38) PTGDR2MEN1KMT2AALPL
SCHEMBL1705525 0.79 APEX1 (0.38) PTGDR2MEN1KMT2AALPL
SCHEMBL7948553 0.79 SMN1; SMN2 (0.38) HSPA5PTGDR2MEN1KMT2A
SCHEMBL9356082 0.77 HSPA5 (0.37) HSPA5TRPA1MEN1KMT2A
SCHEMBL7951319 0.77 ALDH1A1 (0.38) PTGDR2
SCHEMBL13964102 0.76 LMNA (0.44) HSPA5ALPL
SCHEMBL31588889 0.76 LMNA (0.44) HSPA5ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6231804-B1 USED FOR HOLLOW CONTAINERS, A FILM, A SHEET, A PIPE, FIBER AND MOLDING;A BLEND OF HIGH MOLECULAR WEIGHT POLYETHYLENE COPOLYMER,AN OLEFIN HOMO OR COPLYMER CHISSO CORPORATION (JP) 2001-05-15 US disclosed
EP-0972800-A1 MODIFIED OLEFIN (CO)POLYMER COMPOSITION, PROCESS FOR PREPARING THE SAME, AND MODIFIED OLEFIN (CO)POLYMER COMPOSITION MOLDING CHISSO CORPORATION (JP) 2000-01-19 EP disclosed