SCHEMBL8499648

SCHEMBL8499648

O=C(O)CCCCOc1ccc2ncc(-c3cccc(F)c3)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 7/20 0.55
PDE3A Q14432 7/20 0.55
PDE2A O00408 5/20 0.55
P2RY12 Q9H244 4/20 0.54
PPARA Q07869 2/20 0.48
PPARG P37231 1/20 0.48
FFAR1 O14842 5/20 0.48
FFAR4 Q5NUL3 3/20 0.48
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
LTB4R Q15722 3/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
CYSLTR2 Q9NS75 1/20 0.45
CYSLTR1 Q9Y271 1/20 0.45

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
SCHEMBL8501414 0.88 PDE3B (0.58) PDE3BPDE3APDE2AP2RY12PPARA
SCHEMBL8887112 0.86 PDGFRB (0.45) PDE3BPDE3APDE2AP2RY12PPARA
SCHEMBL8502489 0.85 PDGFRB (0.52) PDE3BPDE3APDE2AP2RY12PDGFRB
Hydrochloric Acid SCHEMBL8503310 0.83 PDGFRB (0.52) PDE3BPDE3APDE2AP2RY12PDGFRB
SCHEMBL8887119 0.82 PDGFRB (0.47) PDE3BPDE3AP2RY12PPARAPPARG
SCHEMBL8501202 0.81 FFAR1 (0.51) FFAR1FFAR4PDGFRBPDGFRA
SCHEMBL8503241 0.79 KMT2A (0.50) PDGFRBPDGFRA
SCHEMBL8501205 0.79 PDGFRB (0.51) PDGFRBPDGFRA
Hydrochloric Acid SCHEMBL8504144 0.79 PDGFRB (0.51) PDGFRBPDGFRA
SCHEMBL8499693 0.79 PDGFRB (0.52) PDGFRBPDGFRA

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-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US claimed
US-RE36256-E ADMINISTERING ARYL-SUBSTITUTED QUINOXALINE DERIVATIVES AS ANTIPROLIFERATIVE, ANTICARCINOGENIC AND ANTITUMOR AGENTS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5795889-A INHIBITING CELL GROWTH WITH ENZYME INHIBITORS FOR SKIN DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-08-18 US disclosed
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed