SCHEMBL2384178

SCHEMBL2384178

CCCc1cccnc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.51
NOS2 P35228 3/20 0.48
NOS3 P29474 2/20 0.48
NOS1 P29475 1/20 0.48
GRM5 P41594 1/20 0.45
TKT P29401 2/20 0.42
TLR8 Q9NR97 1/20 0.41
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
KDM4E B2RXH2 1/20 0.38
SLC19A2 O60779 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CASP1 P29466 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
VCP P55072 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38

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
SCHEMBL8049756 0.88 BACE1 (0.49) BACE1NOS2NOS3NOS1TKT
SCHEMBL750976 0.86 TLR8 (0.49) BACE1NOS2NOS3NOS1TLR8
SCHEMBL28020387 0.85 TLR8 (0.47) BACE1NOS2NOS3NOS1TLR8
SCHEMBL27725467 0.85 TLR8 (0.47) BACE1NOS2NOS3NOS1TLR8
SCHEMBL11401202 0.85 TLR8 (0.47) BACE1NOS2NOS3NOS1TLR8
SCHEMBL6982374 0.85 TLR8 (0.47) BACE1NOS2NOS3NOS1TLR8
Hydrochloric Acid SCHEMBL8582822 0.83 TLR8 (0.46) BACE1NOS2NOS3NOS1TLR8
SCHEMBL293456 0.83
SCHEMBL30154778 0.83
SCHEMBL13699313 0.82 BACE1 (0.44) BACE1NOS2NOS3NOS1GRM5

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111643129-B Chitosan and polyethylene glycol copolymer and method and apparatus for sealing vascular perforations using the same 通合公司 2024-06-11 CN disclosed
CN-110952077-B Method for forming metal film 株式会社FLOSFIA 2022-09-13 CN disclosed
CN-113336750-B Dithioacetal-containing pyridopyrimidone derivative and preparation and application thereof 贵州大学 2022-06-07 CN disclosed
EP-2990503-B1 METHOD OF FORMING METAL FILM FLOSFIA INC (JP) 2022-01-12 EP disclosed
CN-113336750-A Dithioacetal-containing pyridopyrimidone derivative and preparation and application thereof 贵州大学 2021-09-03 CN disclosed
US-20210221784-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PAIN UNIVERSITÉ DE STRASBOURG (FR) 2021-07-22 US disclosed
EP-3749305-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PAIN Université de Strasbourg (FR) 2020-12-16 EP disclosed
CN-111643129-A Chitosan and polyethylene glycol copolymers and methods and devices for sealing vascular perforations using the same 通合公司 2020-09-11 CN disclosed
CN-110952077-A Method for forming metal film 株式会社FLOSFIA 2020-04-03 CN disclosed
CN-105386008-B Method for forming metal film 株式会社FLOSFIA 2020-01-21 CN disclosed
US-6468741-B1 Electrochemiluminescent rhenium moieties IGEN INTERNATIONAL, INC. 2002-10-22 US disclosed
US-5811236-A QUANTITATIVE, QUALITATIVE ANALYSIS IGEN INTERNATIONAL, INC. (US) 1998-09-22 US disclosed
US-5716781-A FORMING A SOLUTION CONTAINING AN ANALYTE COMPRISING FIRST CHEMILUMINESCENT COMPLEX AND AN INTERNAL STANDARD CONTAINING OSMIUM BIPYRIDYL COMPLEX, INDEPENDENTLY MEASURING ELECTROLUMINESCENCE EMITTED BY ANALYTE AND STANDARD IGEN INTERNATIONAL INC. (US) 1998-02-10 US disclosed
US-5591581-A Electrochemiluminescent rhenium moieties and methods for their use IGEN, INC. (US) 1997-01-07 US disclosed
EP-0339086-B1 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS IGEN INC (US) 1996-09-11 EP disclosed
EP-0674176-A1 Electrochemiluminescent rhenium moieties and methods of production IGEN, INC. (US) 1995-09-27 EP disclosed
EP-0339086-A4 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS. IGEN INC (US) 1990-02-20 EP disclosed
EP-0339086-A1 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS IGEN, INC. (US) 1989-11-02 EP disclosed
WO-1989004302-A1 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS IGEN, INC. (US) 1989-05-18 WO disclosed
US-4457932-A GASTROINTESTINAL DISORDERS BRISTOL-MYERS COMPANY (US) 1984-07-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210221784-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PAIN ACHE, TRPV1, OPRL1 BACE1 3964/4885NOS2 1125/4885NOS3 725/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.