SCHEMBL7904117

SCHEMBL7904117

O=C(O)CCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.60
HRH1 P35367 1/20 0.59
HRH3 Q9Y5N1 1/20 0.59
POLB P06746 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
FAAH O00519 1/20 0.55
CNR1 P21554 1/20 0.53

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
SCHEMBL7776766 0.99 HRH1 (0.60) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL14524946 0.94 HRH1 (0.61) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL31243785 0.88 CNR1 (0.70) SIGMAR1HRH1HRH3CNR1
SCHEMBL7775266 0.86 NPC1 (0.52) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL7775252 0.85 HRH1 (0.56) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL9697267 0.84 POLB (0.56) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL14560427 0.83 FAAH (0.78) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL31391950 0.82 CNR1 (0.54) SIGMAR1HRH1HRH3POLBTDP1
SCHEMBL31318279 0.82 CNR1 (0.73) HRH1HRH3POLBTDP1CNR1
SCHEMBL7773267 0.81 NPC1 (0.55) SIGMAR1HRH1HRH3POLBTDP1

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
US-6242268-B1 USING WATER-SOLUBLE, FLUORESCENT, RARE EARTH METAL CHELATES AS TAGS ON SPECIFIC BINDING PARTNERS AND DETECTING FLUORESCENT EMISSION FROM SAMPLE AFTER FLUORESCENCE OF AMBIENT SUSBTANCES HAVE DECAYED EG&G WALLAC (FI) 2001-06-05 US disclosed
US-5830769-A QUANTITATIVE ANALYSIS; MEASURING FLUORESCENT EMISSION PERKINELMER LIFE SCIENCES, INC. 1998-11-03 US disclosed
EP-0272320-B1 HOMOGENEOUS FLUOROASSAY METHODS EMPLOYING FLUORESCENT BACKGROUND REJECTION BAXTER DIAGNOSTICS INC (US) 1994-03-23 EP disclosed