SCHEMBL30697705

SCHEMBL30697705

CCC(Sc1ncccc1C#N)C(c1ccccc1)C(C#N)C#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.41
ALDH1A1 P00352 7/20 0.41
CYP2D6 P10635 5/20 0.39
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 3/20 0.39
NOS2 P35228 3/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
KDM4E B2RXH2 3/20 0.34
SLC22A12 Q96S37 2/20 0.34
GAA P10253 1/20 0.34
POLB P06746 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 2/20 0.33

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
SCHEMBL26118403 1.00 HPGD (0.41) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL30697701 1.00 HPGD (0.41) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL26116705 0.81 HPGD (0.41) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL30697695 0.81 HPGD (0.41) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL30697706 0.74 L3MBTL1 (0.36) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL26120763 0.74 L3MBTL1 (0.36) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL30697709 0.74 CYP2D6 (0.45) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL26120013 0.74 CYP2D6 (0.45) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL30697700 0.73 HPGD (0.45) HPGDALDH1A1CYP2D6SLC6A2SLC6A4
SCHEMBL26121636 0.73 HPGD (0.45) HPGDALDH1A1CYP2D6SLC6A2SLC6A4

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
EP-4504706-A1 PROCESS FOR THE PREPARATION OF DIVERSELY SUBSTITUTED CYANOCYCLOPROPYL - HETEROARENES OR ARENES Syngenta Crop Protection AG (CH) 2025-02-12 EP 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