SCHEMBL7073972

SCHEMBL7073972

c1ccc(CCc2nccc3ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.55
KDM4E B2RXH2 5/20 0.50
RAB9A P51151 2/20 0.50
CYP2A6 P11509 1/20 0.46
F12 P00748 1/20 0.46
PLAU P00749 1/20 0.46
NCF1 P14598 1/20 0.46
NOS3 P29474 1/20 0.46
NOS1 P29475 1/20 0.46
NOS2 P35228 1/20 0.46
BACE1 P56817 1/20 0.46
MPO P05164 1/20 0.43
KCNH2 Q12809 1/20 0.42
LMNA P02545 2/20 0.41
CFTR P13569 1/20 0.41
GOPC Q9HD26 1/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL31756882 1.00 ACHE (0.55) ACHEKDM4ERAB9ACYP2A6F12
Bromide SCHEMBL8857652 0.98 ACHE (0.53) ACHEKDM4ERAB9ACYP2A6F12
SCHEMBL10477025 0.91 ACHE (0.53) ACHEKDM4ERAB9ACYP2A6F12
Hydrochloric Acid SCHEMBL9852596 0.89 ACHE (0.52) ACHEKDM4ERAB9ACYP2A6F12
SCHEMBL1446013 0.88 ACHE (0.48) ACHEKDM4ERAB9ACYP2A6F12
SCHEMBL1445784 0.85 ACHE (0.49) ACHERAB9ACYP2A6F12PLAU
SCHEMBL30711500 0.84 KDM4E (0.46) ACHEKDM4ERAB9AMPOKCNH2
SCHEMBL12373355 0.84 ACHE (0.45) ACHEKDM4ERAB9ACYP2A6F12
SCHEMBL29373118 0.83 ACHE (0.49) ACHERAB9ACYP2A6F12PLAU
SCHEMBL232662 0.83 ACHE (0.49) ACHERAB9ACYP2A6F12PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110628784-B NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2022-10-25 CN claimed
CN-110628784-A NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2019-12-31 CN claimed
EP-0558392-A1 Process for the stabilisation of a charge transfer complex based on 7,7,8,8-tetracyanoquinodimethane COMPAGNIE EUROPEENNE DE COMPOSANTS ELECTRONIQUES LCC (FR) 1993-09-01 EP claimed
CN-122038251-A Preparation method and application of microorganism for producing 1-phenethyl isoquinoline 中国科学院分子植物科学卓越创新中心 2026-05-15 CN disclosed
CN-119876073-A Method for synthesizing Rotundine and derivative thereof and construction of whole-cell catalytic system 江南大学 2025-04-25 CN disclosed
CN-117660386-A Method for synthesizing (S) -authnamline and derivative thereof and construction of whole-cell catalytic system 江南大学 2024-03-08 CN disclosed
CN-110628784-B NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2022-10-25 CN disclosed
CN-110628784-B NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2022-10-25 CN disclosed
CN-110628784-A NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2019-12-31 CN disclosed
CN-110628784-A NCS-like PR10 gene and application thereof 中国热带农业科学院热带作物品种资源研究所 2019-12-31 CN disclosed
WO-2003059928-A1 POLYNUCLEOTIDE ENCODING AN AP-2 DOMAIN TRANSCRIPTION FACTOR AVESTHA GENGRAINE TECHNOLOGIES PVT. LTD. (IN) 2003-07-24 WO disclosed
EP-0558392-A1 Process for the stabilisation of a charge transfer complex based on 7,7,8,8-tetracyanoquinodimethane COMPAGNIE EUROPEENNE DE COMPOSANTS ELECTRONIQUES LCC (FR) 1993-09-01 EP disclosed