SCHEMBL499765

SCHEMBL499765

CN(C)CC(O)C(c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SLC6A2 P23975 12/20 0.49
SLC6A4 P31645 12/20 0.49
SLC6A3 Q01959 9/20 0.49
CYP2D6 P10635 2/20 0.49
CYP3A4 P08684 1/20 0.49
HTR2A P28223 3/20 0.48
HRH1 P35367 3/20 0.48
AOC3 Q16853 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KCNH2 Q12809 3/20 0.44
CHRM2 P08172 2/20 0.44
CHRM5 P08912 2/20 0.44
CHRM1 P11229 2/20 0.44
ADRA2B P18089 2/20 0.44
HRH2 P25021 2/20 0.44
HRH3 Q9Y5N1 2/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL11632527 0.89 HTR2A (0.59) LMNASLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11637671 0.87 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
Clemeprol SCHEMBL499766 0.86 SLC6A2 (0.50) LMNASLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11632564 0.85 HTR2A (0.50) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
Clemeprol SCHEMBL11132757 0.84 SLC6A2 (0.49) LMNASLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11633139 0.84 SLC6A4 (0.66) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
SCHEMBL11635465 0.83 SLC6A2 (0.49) LMNASLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11634860 0.83 HTR2A (0.48) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
SCHEMBL13567535 0.81 SLC6A2 (0.49) LMNASLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11634457 0.81 ALDH1A1 (0.54) SLC6A2SLC6A4SLC6A3HTR2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022159507-A1 COMBINATION OF CANNABINOIDS WITH ADDITIONAL THERAPEUTIC AGENTS FOR TREATING DISEASES OR DISORDERS MERIT THERAPEUTICS, INC. (US) 2022-07-28 WO claimed
WO-2022159506-A1 DEUTERATED CANNABIDIOL COMPOUNDS MERIT THERAPEUTICS, INC. (US) 2022-07-28 WO claimed
US-9016221-B2 Surface topographies for non-toxic bioadhesion control UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-28 US claimed
CN-102143961-B Benzoxazines, benzothiazines, and related compounds having NOS inhibitory activity NEURAXON INC 2014-11-05 CN claimed
US-8586620-B2 Substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2013-11-19 US claimed
JP-2011526251-A 2011-10-06 JP claimed
US-20110212947-A1 SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NEURAXON INC. (CA) 2011-09-01 US claimed
CN-102143961-A Benzoxazines, benzothiazines, and related compounds having NOS inhibitory activity NEURAXON INC 2011-08-03 CN claimed
EP-2310386-A1 BENZOXAZINES, BENZOTHIAZINES, AND RELATED COMPOUNDS HAVING NOS INHIBITORY ACTIVITY Neuraxon Inc. (CA) 2011-04-20 EP claimed
EP-1883451-B9 SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NEURAXON INC (CA) 2011-02-09 EP claimed
WO-2007061529-A1 LYOPHILIZATION PROCESS AND PRODUCTS OBTAINED THEREBY SCIDOSE LLC. (US) 2007-05-31 WO claimed
US-20070116729-A1 Lyophilization process and products obtained thereby SCIDOSE LLC 2007-05-24 US claimed
WO-2007017764-A2 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS WITH DUAL NOS INHIBITORY ACTIVITY AND MUOPIOID AGONIST ACTIVITY NEURAXON, INC. (CA) 2007-02-15 WO claimed
EP-1737473-A2 LITHIUM COMBINATIONS, AND USES RELATED THERETO Satow, Philip, Maxwell (US) 2007-01-03 EP claimed
US-20060258721-A1 Substituted indole compounds having NOS inhibitory activity NEURAXON INC. (CA) 2006-11-16 US claimed
US-20060258715-A1 Therapeutic combinations for the treatment or prevention of depression WYETH (US) 2006-11-16 US claimed
WO-2006116149-A1 NEW THERAPEUTIC COMBIANATIONS FOR THE TREATMENT OR PREVENTION OF DEPRESSION WYETH (US) 2006-11-02 WO claimed
WO-2005102366-A2 LITHIUM COMBINATIONS, AND USES RELATED THERETO SATOW PHILIP MAXWELL (US) 2005-11-03 WO claimed
US-20050233010-A1 Lithium combinations, and uses related thereto NOVEN THERAPEUTICS, LLC 2005-10-20 US claimed
US-4101676-A Diphenylpropylamines to treat depression BEECHAM GROUP LIMITED (GB) 1978-07-18 US claimed

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

For each of this compound's patents that has machine-readable text (4 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-20060258715-A1 Therapeutic combinations for the treatment or prevention of depression GRIN3A, GRIN2A, BDNF LMNA 1081/4885SMN1; SMN2 2577/4885SLC6A2 36/4885
US-20110212947-A1 SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NOS2, NOS1, NOS3 LMNA 3365/4885SMN1; SMN2 1258/4885SLC6A2 920/4885
US-20050233010-A1 Lithium combinations, and uses related thereto NPY4R, ADRA1D, HTR4 LMNA 2800/4885SMN1; SMN2 3620/4885SLC6A2 28/4885
US-20060258721-A1 Substituted indole compounds having NOS inhibitory activity NOS2, NOS1, NOS3 LMNA 3365/4885SMN1; SMN2 1258/4885SLC6A2 920/4885

“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.