SCHEMBL30697709

SCHEMBL30697709

N#Cc1cccnc1SC(CC(C#N)C#N)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.45
SLC6A2 P23975 3/20 0.45
SLC6A4 P31645 3/20 0.45
NOS2 P35228 3/20 0.45
HPGD P15428 7/20 0.43
ALDH1A1 P00352 7/20 0.43
SLC22A12 Q96S37 4/20 0.40
CXCR2 P25025 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
POLB P06746 2/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL26120013 1.00 CYP2D6 (0.45) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL6748211 0.82 CYP2D6 (0.45) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697693 0.79 SLC22A12 (0.37) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697694 0.79 SLC22A12 (0.37) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL26125835 0.79 SLC22A12 (0.37) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697701 0.74 HPGD (0.41) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697705 0.74 HPGD (0.41) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697695 0.74 HPGD (0.41) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL30697699 0.74 HPGD (0.38) CYP2D6SLC6A2SLC6A4NOS2HPGD
SCHEMBL26116705 0.74 HPGD (0.41) CYP2D6SLC6A2SLC6A4NOS2HPGD

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
EP-4504706-A1 PROCESS FOR THE PREPARATION OF DIVERSELY SUBSTITUTED CYANOCYCLOPROPYL - HETEROARENES OR ARENES Syngenta Crop Protection AG (CH) 2025-02-12 EP disclosed
CN-119032081-A Process for preparing various substituted cyanocyclopropyl-heteroarenes or arenes 先正达农作物保护股份公司 2024-11-26 CN disclosed
WO-2023194496-A1 PROCESS FOR THE PREPARATION OF DIVERSELY SUBSTITUTED CYANOCYCLOPROPYL - HETEROARENES OR ARENES SYNGENTA CROP PROTECTION AG (CH) 2023-10-12 WO disclosed