SCHEMBL5694548

SCHEMBL5694548

ClC=CCN1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.38
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CXCR4 P61073 8/20 0.34
MEN1 O00255 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
ADRA2C P18825 1/20 0.34
CCR2 P41597 1/20 0.34
CXCL12 P48061 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL7708108 1.00 SIGMAR1 (0.38) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL7710694 1.00 SIGMAR1 (0.38) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL7708139 0.86
SCHEMBL7708147 0.86
SCHEMBL7707623 0.77
SCHEMBL7707620 0.77
SCHEMBL7708132 0.77
SCHEMBL175418 0.76 POLB (0.35) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL7710736 0.76 SMN1; SMN2 (0.35) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL1481327 0.76 POLB (0.35) SIGMAR1POLBSMN1; SMN2CXCR4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3013824-B1 CARBOLINE COMPOUNDS USABLE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES ALZPROTECT (FR) 2018-05-16 EP disclosed
US-9714245-B2 Carboline compounds usable in the treatment of neurodegenerative diseases ALZPROTECT (FR) 2017-07-25 US disclosed
US-20160152610-A1 Carboline Compounds Usable in The Treatment of Neurodegenerative Diseases INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2016-06-02 US disclosed
EP-3013824-A1 CARBOLINE COMPOUNDS USABLE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Alzprotect (FR) 2016-05-04 EP disclosed
WO-2014207241-A1 NEW Na-SUBSTITUTED CARBOLINE COMPOUNDS USABLE FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES ALZPROTECT (FR) 2014-12-31 WO disclosed
WO-2014207240-A1 CARBOLINE COMPOUNDS USABLE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES ALZPROTECT (FR) 2014-12-31 WO disclosed
EP-1171133-B1 R-HYDROXYNEFAZODONE SEPRACOR INC (US) 2006-06-21 EP disclosed
EP-1358171-A2 NOVEL UREA DERIVATIVES, METHOD FOR PREPARING SAME, USE THEREOF AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE Aventis Pharma S.A. (FR) 2003-11-05 EP disclosed
US-6465470-B2 TREATMENT FOR DEPRESSION WHICH DOES NOT GIVE RISE TO THE ADVERSE EFFECTS ASSOCIATED WITH NEFAZODONE; ALSO USEFUL IN THE TREATMENT OF MIGRAINE HEADACHES, PANIC DISORDERS, POST TRAUMATIC STRESS DISORDER AND SLEEP DISORDERS. SEPRACOR INC. 2002-10-15 US disclosed
US-6465469-B1 S-hydroxynefazodone SEPRACOR INC. 2002-10-15 US disclosed
WO-2002059102-A2 UREA DERIVATIVES, METHOD FOR PREPARING SAME, USE THEREOF AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND USE AVENTIS PHARMA S.A. (FR) 2002-08-01 WO disclosed
US-6384037-B1 TREATMENT OF PSYCHIATRIC ILLNESS, ANTIDEPRESSANTS, SLEEP DISORDERS AND ANALGESICS SEPRACOR INC. 2002-05-07 US disclosed
US-20020052382-A1 R-hydroxynefazodone SEPRACOR INC. 2002-05-02 US disclosed
EP-1189616-A2 S-HYDROXYNEFAZODONE Sepracor Inc. (US) 2002-03-27 EP disclosed
US-6359174-B1 REACTING ALLYL REACTANT WITH ACID CHLORIDE IN PRESENCE OF LEWIS ACID CATALYST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-03-19 US disclosed
EP-1171133-A2 R-HYDROXYNEFAZODONE Sepracor Inc. (US) 2002-01-16 EP disclosed
WO-2000061129-A2 S-HYDROXYNEFAZODONE SEPRACOR INC. (US) 2000-10-19 WO disclosed
WO-2000061128-A2 R-HYDROXYNEFAZODONE SEPRACOR INC. (US) 2000-10-19 WO 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 (2 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-20020052382-A1 R-hydroxynefazodone OPRD1, HTR4, HTR3E SIGMAR1 106/4885POLB 2071/4885SMN1; SMN2 2145/4885
US-20160152610-A1 Carboline Compounds Usable in The Treatment of Neurodegenerative Diseases SNCA, PARK7, HTT SIGMAR1 923/4885POLB 1835/4885SMN1; SMN2 20/4885

“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.