SCHEMBL42121

SCHEMBL42121

C1CCC(CN2CC[N]CC2)CC1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.67
ADRA2C P18825 1/20 0.67
ACHE P22303 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.46
CASP1 P29466 1/20 0.44
CASP4 P49662 1/20 0.44
CASP5 P51878 1/20 0.44
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
OPRM1 P35372 4/20 0.40
OPRL1 P41146 4/20 0.40
OPRK1 P41145 2/20 0.40
OPRD1 P41143 1/20 0.40
TRPC5 Q9UL62 1/20 0.39
CYP2B6 P20813 1/20 0.38
SIGMAR1 Q99720 3/20 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
SCHEMBL137914 0.88 CHRM5 (0.48) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL5949588 0.84 CHRM5 (0.52) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL5376134 0.83 CHRM5 (0.84) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL11596303 0.83 CHRM5 (0.84) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL41997 0.82 CHRM5 (0.67) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL1515104 0.80 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL3439903 0.80 CHRM5 (0.90) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL20643257 0.80 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL3439882 0.80 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CASP1
SCHEMBL30340995 0.80 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US claimed
US-11731947-B2 Deuterated antimicrobial compounds UNIVERSITY OF NOTRE DAME DU LAC (US) 2023-08-22 US claimed
US-20220204463-A1 DEUTERATED ANTIMICROBIAL COMPOUNDS UNIVERSITY OF NOTRE DAME DU LAC (US) 2022-06-30 US claimed
US-11319306-B2 Compositions and methods for treating neurodegenerative diseases AZEVAN PHARMACEUTICALS, INC. (US) 2022-05-03 US claimed
EP-3351104-B1 COMPOUNDS FOR USE IN THE TREATMENT OF INTERMITTENT EXPLOSIVE DISORDER AZEVAN PHARMACEUTICALS INC (US) 2020-12-09 EP claimed
WO-2020210125-A1 DEUTERATED ANTIMICROBIAL COMPOUNDS UNIVERSITY OF NOTRE DAME DU LAC (US) 2020-10-15 WO claimed
EP-3515920-A1 NEW ANTIMICROBIAL COMPOUNDS, THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS AND A NEW METABOLIC MECHANISM Leibniz-Institut für Naturstoff-Forschung und Infektionsbiologie e.V. -Hans-Knöll-Institut- (HKI) (DE) 2019-07-31 EP claimed
EP-3363788-A1 CANNABINOID RECEPTOR MODULATORS Arena Pharmaceuticals, Inc. (US) 2018-08-22 EP claimed
WO-2018055048-A1 NEW ANTIMICROBIAL COMPOUNDS, THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS AND A NEW METABOLIC MECHANISM LEIBNIZ-INSTITUT FÜR NATURSTOFF-FORSCHUNG UND INFEKTIONSBIOLOGIE E.V. HANS-KNÖLL INSTITUT (HKI) (DE) 2018-03-29 WO claimed
US-9597314-B2 Beta-lactamylalkanoic acids for treating premenstrual disorders AZEVAN PHARMACEUTICALS, INC. (US) 2017-03-21 US claimed
US-20130165412-A1 CANNABINOID RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2013-06-27 US claimed
WO-2013070657-A1 MODULATORS OF THE G PROTEIN-COUPLED MAS RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2013-05-16 WO claimed
US-20120214766-A1 CANNABINOID RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2012-08-23 US claimed
US-7943605-B2 Compounds comprising a lactam or a lactam derivative moiety, processes for making them, and their uses UCB PHARMA S.A. (BE) 2011-05-17 US claimed
US-20090023708-A1 Compounds Comprising a Lactam or a Lactam Derivative Moiety, Processes for Making Them, and Their Uses UCB PHARMA, S.A. (BE) 2009-01-22 US claimed
EP-1943217-A1 COMPOUNDS COMPRISING A LACTAM OR A LACTAM DERIVATIVE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB Pharma, S.A. (BE) 2008-07-16 EP claimed
EP-1877401-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM Elan Pharmaceuticals Inc. (US) 2008-01-16 EP claimed
WO-2007048595-A1 COMPOUNDS COMPRISING A LACTAM OR A LACTAM DERIVATIVE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB PHARMA, S.A. (BE) 2007-05-03 WO claimed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US claimed
WO-2006113140-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM ELAN PHARMACEUTICALS, INC. (US) 2006-10-26 WO 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 (8 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-20220204463-A1 DEUTERATED ANTIMICROBIAL COMPOUNDS TALDO1, TXNRD1, NQO1 CHRM5 4385/4885ADRA2C 2432/4885ACHE 3311/4885
US-20120214766-A1 CANNABINOID RECEPTOR MODULATORS CNR1, CNR2, TRPV1 CHRM5 140/4885ADRA2C 314/4885ACHE 136/4885
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT CHRM5 1450/4885ADRA2C 2577/4885ACHE 18/4885
US-11731947-B2 Deuterated antimicrobial compounds TALDO1, TXNRD1, TXNRD3 CHRM5 4438/4885ADRA2C 2354/4885ACHE 3409/4885
US-20090023708-A1 Compounds Comprising a Lactam or a Lactam Derivative Moiety, Processes for Making Them, and Their Uses COASY, FURIN, PEPD CHRM5 4048/4885ADRA2C 3275/4885ACHE 194/4885
US-11319306-B2 Compositions and methods for treating neurodegenerative diseases HTT, AVPR2, AVPR1B CHRM5 322/4885ADRA2C 114/4885ACHE 98/4885
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism BDKRB1, BDKRB2, NPBWR1 CHRM5 2067/4885ADRA2C 357/4885ACHE 2716/4885
US-20130165412-A1 CANNABINOID RECEPTOR MODULATORS CNR1, CNR2, TRPV1 CHRM5 140/4885ADRA2C 314/4885ACHE 136/4885

“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.