SCHEMBL28348348

SCHEMBL28348348

NCCCCC1CCNC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.48
SLC6A1 P30531 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRB2 P47870 2/20 0.41
SLC6A12 P48065 2/20 0.41
SLC6A11 P48066 2/20 0.41
SLC6A13 Q9NSD5 2/20 0.41
GABRA1 P14867 1/20 0.41
GABRR1 P24046 1/20 0.41
GABRA4 P48169 1/20 0.41
RAD52 P43351 1/20 0.36
HRH3 Q9Y5N1 7/20 0.35
POLB P06746 1/20 0.35
HRH4 Q9H3N8 4/20 0.33
NAAA Q02083 1/20 0.33
GLA P06280 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NFKB1 P19838 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL5012792 0.93
Iodide SCHEMBL9406522 0.91 SLC6A1 (0.41) SIGMAR1SLC6A1GABRA5GABRB2SLC6A12
SCHEMBL197822 0.88 SIGMAR1 (0.55) SIGMAR1RAD52HRH3POLBHRH4
SCHEMBL3389547 0.86 SIGMAR1 (0.58) SIGMAR1RAD52HRH3POLBNFKB1
SCHEMBL20854154 0.86 SLC6A1 (0.46) SIGMAR1SLC6A1GABRA5GABRB2SLC6A12
SCHEMBL21799827 0.84 SIGMAR1 (0.61) SIGMAR1RAD52HRH3SLC6A4
SCHEMBL21799990 0.84 SIGMAR1 (0.61) SIGMAR1RAD52HRH3SLC6A4
SCHEMBL21800083 0.84 SIGMAR1 (0.61) SIGMAR1RAD52HRH3SLC6A4
SCHEMBL21800014 0.84 SIGMAR1 (0.61) SIGMAR1RAD52HRH3SLC6A4
SCHEMBL21799624 0.84 SIGMAR1 (0.61) SIGMAR1RAD52HRH3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106914234-B 'Almond-shaped' Mn2O3Preparation method of/C particles 广西大学 2020-11-06 CN claimed
CN-106887606-B Peach-shaped Mn2O3preparation method of/C particles 广西大学 2019-12-13 CN claimed
WO-2024149370-A1 COMPOUND, PREPARATION METHOD, AND LIPID NANOPARTICLES AND PHARMACEUTICAL COMPOSITION THEREOF 苏州慧疗生物医药科技有限公司 2024-07-18 WO disclosed
CN-117050130-A Lipid compounds and compositions, preparation and uses thereof 苏州慧疗生物医药科技有限公司 2023-11-14 CN disclosed
CN-117045806-A Lipid composition, preparation and use thereof 苏州慧疗生物医药科技有限公司 2023-11-14 CN disclosed
CN-105753768-B Production method of single nitrogen heterocyclic compound 北京恒瑞新霖科技有限公司 2020-11-27 CN disclosed
CN-106914234-B 'Almond-shaped' Mn2O3Preparation method of/C particles 广西大学 2020-11-06 CN disclosed
CN-106887606-B Peach-shaped Mn2O3preparation method of/C particles 广西大学 2019-12-13 CN disclosed