SCHEMBL789435

SCHEMBL789435

CCCCC1CNCC[N]1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 0.35
NOS2 P35228 5/20 0.35
NOS3 P29474 1/20 0.32
CYP1A2 P05177 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
GLB1 P16278 1/20 0.31
CYP2D6 P10635 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL254648 0.94 GBA1 (0.33) NOS1NOS2NOS3MAOAMAOB
SCHEMBL3254586 0.92 ALDH1A1 (0.36) GLB1
SCHEMBL789308 0.89
SCHEMBL10701436 0.84 SPHK2 (0.35) NOS1MAOAMAOB
SCHEMBL10702646 0.82 SCN2A (0.34) NOS1NOS2
SCHEMBL8026346 0.82 CHRM1 (0.37) MAOAMAOB
SCHEMBL3715413 0.81 SCN2A (0.36) NOS1NOS2GLB1
SCHEMBL459100 0.80
SCHEMBL8042080 0.80 MAOA (0.31) MAOAMAOB
SCHEMBL6266022 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110128373-B Piperazinyl tin complex, preparation method thereof, thin film and solar cell 鸿翌科技有限公司 2023-03-24 CN claimed
US-4279912-A ANTIALLERGENS, BRONCHODILATORS ROUSSEL UCLAF (FR) 1981-07-21 US claimed
US-4091115-A ANTIDEPRESSANTS ROUSSEL UCLAF (FR) 1978-05-23 US claimed
US-11273168-B2 Methods of treating anxiety by administering a substituted quinolone OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-03-15 US disclosed
EP-3833352-A2 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS University of Central Florida Research Foundation, Inc. (US) 2021-06-16 EP disclosed
US-20200281951-A1 HETEROCYCLIC COMPOUNDS FOR TREATING OR PREVENTING DISORDERS CAUSED BY REDUCED NEUROTRANSMISSION OF SEROTONIN, NOREPHNEPHRINE OR DOPAMINE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-09-10 US disclosed
US-10603331-B2 Method of treating disorders caused by reduced neurotransmission of serotonin, norephnephrine or dopamine OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-03-31 US disclosed
WO-2020033944-A2 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2020-02-13 WO disclosed
EP-3311813-B1 THERAPEUTIC ISOXAZOLE COMPOUNDS DART NEUROSCIENCE CAYMAN LTD (KY) 2019-08-07 EP disclosed
US-20190142852-A1 HETEROCYCLIC COMPOUNDS FOR TREATING OR PREVENTING DISORERS CAUSED BY REDUCED NEUROTRANSMISSION OF SEROTONIN, NOREPHNEPHRINE OR DOPAMINE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-05-16 US disclosed
US-10064879-B2 Method for treating depression and/or depression status with substituted quinoxaline compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-09-04 US disclosed
EP-0275381-A2 Dye transfer process BASF Aktiengesellschaft (DE) 1988-07-27 EP disclosed
US-4760049-A Dye transfer BASF AKTIENGESELLSCHAFT (DE) 1988-07-26 US disclosed
EP-0273307-A2 Method of transferring cationic dyes in their de-protonated, electrically neutral form BASF Aktiengesellschaft (DE) 1988-07-06 EP disclosed
US-4649149-A ANTHELMINTICS CIBA-GEIGY CORPORATION (US) 1987-03-10 US disclosed
US-4511567-A ANTHELMINTICS CIBA-GEIGY CORPORATION (US) 1985-04-16 US disclosed
US-4279912-A ANTIALLERGENS, BRONCHODILATORS ROUSSEL UCLAF (FR) 1981-07-21 US disclosed
US-4154852-A ANTIDEPRESSANTS ROUSSEL UCLAF (FR) 1979-05-15 US disclosed
US-4145419-A ANTIALLERGENS, BRONCHODILATORS ROUSSEL UCLAF (FR) 1979-03-20 US disclosed
US-4091115-A ANTIDEPRESSANTS ROUSSEL UCLAF (FR) 1978-05-23 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 (5 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-11273168-B2 Methods of treating anxiety by administering a substituted quinolone CRH, MC2R, HTR3C NOS1 2208/4885NOS2 1743/4885NOS3 1868/4885
US-20200281951-A1 HETEROCYCLIC COMPOUNDS FOR TREATING OR PREVENTING DISORDERS CAUSED BY REDUCED NEUROTRANSMISSION OF SEROTONIN, NOREPHNEPHRINE OR DOPAMINE MC2R, SLC6A2, CRH NOS1 386/4885NOS2 646/4885NOS3 283/4885
US-20190142852-A1 HETEROCYCLIC COMPOUNDS FOR TREATING OR PREVENTING DISORERS CAUSED BY REDUCED NEUROTRANSMISSION OF SEROTONIN, NOREPHNEPHRINE OR DOPAMINE HCRTR1, NPSR1, NTSR1 NOS1 365/4885NOS2 499/4885NOS3 284/4885
US-10603331-B2 Method of treating disorders caused by reduced neurotransmission of serotonin, norephnephrine or dopamine MC2R, PNMT, SLC6A2 NOS1 465/4885NOS2 701/4885NOS3 398/4885
US-10064879-B2 Method for treating depression and/or depression status with substituted quinoxaline compounds KYNU, CRH, CHRM1 NOS1 547/4885NOS2 535/4885NOS3 403/4885

“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.