SCHEMBL28035949

SCHEMBL28035949

CCCCCCCCCCCCCCCCCCNc1ccccc1C=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
CHRM2 P08172 1/20 0.44
CNR2 P34972 4/20 0.43
NAAA Q02083 1/20 0.41
EPHX1 P07099 3/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
CNR1 P21554 1/20 0.41
P2RX7 Q99572 1/20 0.40
EGFR P00533 1/20 0.40
S1PR2 O95136 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ELANE P08246 2/20 0.40
ALDH1A1 P00352 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
SCHEMBL7285847 0.98 L3MBTL1 (0.46) L3MBTL1CHRM2CNR2NAAAEPHX1
SCHEMBL4947158 0.93 CYP2C9 (0.44) L3MBTL1CHRM2CNR2LMNASMN1; SMN2
SCHEMBL9104213 0.87 L3MBTL1 (0.43) L3MBTL1CHRM2CNR2NAAAEPHX1
SCHEMBL5546038 0.86 MEN1 (0.44) CHRM2EPHX1LMNASMN1; SMN2ALDH1A1
SCHEMBL13464216 0.84 L3MBTL1 (0.43) L3MBTL1CHRM2CNR2SIGMAR1CNR1
SCHEMBL23248725 0.83 L3MBTL1 (0.45) L3MBTL1CHRM2CNR2NAAASIGMAR1
SCHEMBL10623845 0.83 L3MBTL1 (0.45) L3MBTL1CHRM2CNR2NAAASIGMAR1
SCHEMBL27636013 0.83 L3MBTL1 (0.45) L3MBTL1CHRM2CNR2NAAASIGMAR1
SCHEMBL10628478 0.83 L3MBTL1 (0.45) L3MBTL1CHRM2CNR2NAAASIGMAR1
SCHEMBL11623780 0.83 L3MBTL1 (0.43) L3MBTL1CHRM2CNR2NAAASIGMAR1

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
CN-105026171-B Thermal recording medium 株式会社理光 2018-12-14 CN disclosed
CN-105026171-A Thermosensitive recording material RICOH CO LTD 2015-11-04 CN disclosed