SCHEMBL7560407

SCHEMBL7560407

Fc1ccc2[nH]c(Cc3cc4ccccc4[nH]3)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.58
▸ PCSK9 Q8NBP7 5/20 0.53
▸ LOXL2 Q9Y4K0 1/20 0.53
▸ AHR P35869 2/20 0.50
▸ DPP4 P27487 1/20 0.48
▸ GUSB P08236 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ ADRA2B P18089 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ OPRK1 P41145 1/20 0.46
▸ ITK Q08881 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ IDO1 P14902 1/20 0.44

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
SCHEMBL864817 0.91 PCSK9 (0.56) FLT3PCSK9LOXL2AHRHTR1A
SCHEMBL28338445 0.85 LOXL2 (0.69) PCSK9LOXL2AHRHRH3
SCHEMBL29403791 0.85 LOXL2 (0.69) PCSK9LOXL2AHRHRH3
SCHEMBL401081 0.85 LOXL2 (0.69) PCSK9LOXL2AHRHRH3
SCHEMBL28335219 0.83 LOXL2 (0.67) PCSK9LOXL2AHRHRH3
SCHEMBL6994522 0.83 LOXL2 (0.53) PCSK9LOXL2AHRDPP4GUSB
SCHEMBL6991621 0.80 PCSK9 (0.50) PCSK9LOXL2AHRDPP4GUSB
SCHEMBL7492821 0.80 PCSK9 (0.53) FLT3PCSK9LOXL2AHRDPP4
SCHEMBL7495753 0.77 AHR (0.49) PCSK9LOXL2AHRGUSBIDO1
SCHEMBL11811160 0.77 IDO1 (0.49) FLT3PCSK9LOXL2HTR1AADRA2A

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
WO-2002080906-A1 PREVENTION AND TREATMENT OF ENDOMETRIOSIS WITH ARYL HYDROCARBON RECEPTOR BINDING LIGANDS CEDARS-SINAI MEDICAL CENTER (US) 2002-10-17 — — WO disclosed
US-20020147155-A1 Prevention and treatment of endometriosis with aryl hydrocarbon receptor binding ligands CEDARS-SINAI MEDICAL CENTER 2002-10-10 — — US disclosed
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