SCHEMBL20342833

SCHEMBL20342833

C/C(=N\C#N)c1cccc(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ PRSS1 P07477 1/20 0.44
▸ PRSS2 P07478 1/20 0.44
▸ PRSS3 P35030 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.42
▸ PPARG P37231 1/20 0.41
▸ PPARA Q07869 1/20 0.41
▸ KAT6A Q92794 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ERCC5 P28715 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL14667537 0.83 POLB (0.57) POLBMAPTTDP1ALDH1A1LMNA
SCHEMBL4327798 0.78 KMO (0.52) KMOPRSS1PRSS2PRSS3HDAC8
SCHEMBL8310029 0.78 KMO (0.52) KMOPRSS1PRSS2PRSS3HDAC8
SCHEMBL2171300 0.77 NPC1 (0.49) POLBALDH1A1NPC1RAB9A
SCHEMBL2171294 0.77 NPC1 (0.49) POLBALDH1A1NPC1RAB9A
SCHEMBL17428488 0.71 PPARG (0.49) KMOPRSS1PRSS2PRSS3HDAC8
SCHEMBL24704536 0.70 GRIN2B (0.45) KMOPRSS1PRSS2PRSS3PPARG
SCHEMBL13754825 0.70 PRSS1 (0.64) KMOPRSS1PRSS2PRSS3HDAC8
SCHEMBL9526439 0.70 KMO (0.55) KMOPRSS1PRSS2PRSS3HDAC8
SCHEMBL407605 0.70 KMO (0.67) KMOPRSS1PRSS2PRSS3HDAC8

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
EP-2927218-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-07-04 — — EP disclosed
Send feedback