SCHEMBL9570677

SCHEMBL9570677

Cc1ccc(Oc2cc(COCC(c3ccc(F)cc3)C(F)(F)F)ccc2F)cc1C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.39
SLC6A4 P31645 6/20 0.39
KCNH2 Q12809 5/20 0.39
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
TACR1 P25103 1/20 0.32
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
HPGD P15428 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CETP P11597 1/20 0.30
NPC1 O15118 1/20 0.30
HSP90AA1 P07900 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9570739 0.86 FFAR1 (0.34) TACR1
SCHEMBL9560935 0.86 LTA4H (0.36) HTR2ASLC6A4TACR1ESR1ESR2
SCHEMBL9570783 0.85 CACNA1C (0.42) SLC6A4PPARGPPARDPPARATACR1
SCHEMBL9570877 0.85 DPP4 (0.33) SLC6A4TACR1ESR1ESR2
SCHEMBL9570793 0.85 TACR1 (0.39) SLC6A4TACR1
SCHEMBL9570693 0.82 TACR1 (0.36) TACR1
SCHEMBL9570736 0.80 CACNA1C (0.37) HTR2ASLC6A4KCNH2PPARGPPARD
SCHEMBL9570632 0.80 DUT (0.35) TACR1CETPNPC1RAB9A
SCHEMBL9561249 0.80 FFAR1 (0.40) TACR1
SCHEMBL9570771 0.80 FFAR1 (0.35) TACR1CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545891-A2 Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-09 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed