SCHEMBL7200517

SCHEMBL7200517

CCCCCCCc1ccc(N2C(=O)CCCC2=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.65
FAAH O00519 1/20 0.65
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
S1PR1 P21453 3/20 0.47
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HSPD1 P10809 1/20 0.46
ADRB3 P13945 1/20 0.46

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
SCHEMBL19144089 0.82 USP2 (0.54) MGLLFAAHKMT2AS1PR1LMNA
SCHEMBL6140262 0.80 KMT2A (0.58) MGLLKMT2ASMN1; SMN2LMNAKDM4E
SCHEMBL3395815 0.79 MGLL (1.00) MGLLFAAHS1PR1ESR1ADRA2A
SCHEMBL8736182 0.79 MGLL (1.00) MGLLFAAHS1PR1ESR1ADRA2A
SCHEMBL3482538 0.77 MGLL (0.97) MGLLFAAHESR1ADRA2AADORA3
SCHEMBL11818215 0.76 FAAH (0.54) MGLLFAAHS1PR1ESR1ADRA2A
SCHEMBL6597563 0.75 USP2 (0.56) KMT2ALMNAALDH1A1TP53
SCHEMBL18844320 0.74 KMT2A (0.60) MGLLFAAHKMT2ASMN1; SMN2LMNA
SCHEMBL23849704 0.73 ESR1 (0.77) MGLLS1PR1ESR1ADRA2AADORA3
SCHEMBL6681490 0.73 ESR1 (0.77) MGLLS1PR1ESR1ADRA2AADORA3

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-6596669-B1 Comprising a support and two reversible heat-sensitive recording layers having different colors formed on the same side of the support, comprising colorless electron-donative dye precursor and an electron-accepting compound MITSUBISHI PAPER MILLS LIMITED (JP) 2003-07-22 US disclosed
US-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed
US-5817599-A COLORLESS DYE PRECURSOR AND REVERSIBLE COLOR DEVELOPER MITSUBISHI PAPER MILLS LIMITED (JP) 1998-10-06 US disclosed