SCHEMBL9645514

SCHEMBL9645514

CC(Oc1cccc2c(Oc3c(F)cc(C(F)(F)F)cc3Cl)cccc12)C(=O)Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
CCR1 P32246 1/20 0.38
CCR2 P41597 1/20 0.38
TLR7 Q9NYK1 4/20 0.37
POLB P06746 1/20 0.35
MRGPRX4 Q96LA9 3/20 0.34
TLR8 Q9NR97 3/20 0.34
PPARG P37231 3/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DHODH Q02127 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
SCHEMBL9313711 0.93 CCR1 (0.38) HPGDCCR1CCR2TLR7PPARG
SCHEMBL9572366 0.84 TLR7 (0.41) TLR7TLR8PPARGMEN1KMT2A
SCHEMBL9313717 0.84 PTGDR2 (0.41) CCR1CCR2POLBPTGDR2
SCHEMBL9572381 0.84 TLR7 (0.41) TLR7TLR8PPARGMEN1KMT2A
SCHEMBL9811785 0.82 P2RX7 (0.34) HPGDPOLBMRGPRX4PPARGDHODH
SCHEMBL9710817 0.82 SMN1; SMN2 (0.34) MRGPRX4PTGDR2
SCHEMBL9854839 0.82 LMNA (0.33) HPGDPPARG
SCHEMBL9571196 0.81 HPGD (0.49) HPGDMRGPRX4PPARGMEN1KMT2A
SCHEMBL9644988 0.80 MEN1 (0.39) TLR7POLBTLR8MEN1KMT2A
SCHEMBL9711436 0.79 MEN1 (0.41) TLR7POLBTLR8MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5166402-A Herbicidal α-(5-aryloxy-naphthalen-1-yl-oxy)-propionic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1992-11-24 US disclosed
EP-0309864-B1 ALPHA-(5-ARYLOXY-NAPHTHALEN-1-YL-OXY)-PROPIONIC-ACID DERIVATIVES BAYER AG (DE) 1991-05-22 EP disclosed
US-4994601-A Postemergence herbicides BAYER AKTIENGESELLSCHAFT (DE) 1991-02-19 US disclosed
EP-0309864-A1 Alpha-(5-aryloxy-naphthalen-1-yl-oxy)-propionic-acid derivatives BAYER AG (DE) 1989-04-05 EP disclosed