SCHEMBL9871895

SCHEMBL9871895

CCCCCCCCCCC=C(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.52
TSHR P16473 3/20 0.46
THRB P10828 1/20 0.42
FAAH O00519 3/20 0.41
TRPV1 Q8NER1 1/20 0.41
TERT O14746 3/20 0.40
MAPT P10636 2/20 0.40
BLM P54132 2/20 0.40
HSD17B10 Q99714 2/20 0.40
FABP4 P15090 2/20 0.40
PTPN1 P18031 2/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 2/20 0.40
GMNN O75496 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL4189215 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL16933840 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL10396091 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL16933737 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL10397143 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL6058462 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL10397196 1.00 EP300 (0.52) EP300TSHRTHRBFAAHTRPV1
SCHEMBL764808 0.97
SCHEMBL10491615 0.93 FAAH (0.52) FAAHTRPV1TERTMAPTBLM
SCHEMBL10491621 0.93 FAAH (0.52) FAAHTRPV1TERTMAPTBLM

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-4997855-A Nematocides, insecticides, anthelmintics FMC CORPORATION (US) 1991-03-05 US disclosed
US-4876285-A ANTHELMINTIC UTILITY FMC CORPORATION (US) 1989-10-24 US disclosed