SCHEMBL9621847

SCHEMBL9621847

OC(=[Se])c1ccccc1Cc1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
PTPRA P18433 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH1 P35367 1/20 0.39
ABCB1 P08183 1/20 0.39
HTR1A P08908 1/20 0.39
DRD2 P14416 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPT P10636 1/20 0.38
LIN28A Q9H9Z2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL9366996 0.85 L3MBTL1 (0.44) L3MBTL1HRH3LMNAHRH4HRH1
SCHEMBL11833416 0.83 ALDH1A1 (0.53) L3MBTL1PTPRAKDM4ELMNAHTT
SCHEMBL28343693 0.79 L3MBTL1 (0.53) L3MBTL1HRH3MAOAMAOBLMNA
SCHEMBL166483 0.78 PARP10 (0.48) L3MBTL1PTPRAKDM4ELMNAHTT
SCHEMBL29818128 0.78 PARP10 (0.48) L3MBTL1PTPRAKDM4ELMNAHTT
Benzamide SCHEMBL18171705 0.75 PARP10 (0.52) L3MBTL1PTPRAKDM4ELMNAHTT
SCHEMBL19474955 0.74 ALDH1A1 (0.56) L3MBTL1KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL2750237 0.74 HSPA5 (0.58) L3MBTL1HRH3LMNAHRH4HRH1
SCHEMBL9365256 0.74 TSHR (0.52) ALDH1A1MAPTTDP1
SCHEMBL9529562 0.73 KDM4E (0.42) L3MBTL1HRH3KDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5126357-A ANTI-INFLAMMATORY PICOLYSELENOBENZAMIDES AND SALTS THEREOF A. NATTERMANN & CIE. GMBH (DE) 1992-06-30 US disclosed