Arcaine

Arcaine

SCHEMBL303546

N=C(N)NCCCCNC(=N)N

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
CYP1A2 P05177 1/20 0.62
ALOX15 P16050 1/20 0.56
HIF1A Q16665 2/20 0.41
TSHR P16473 1/20 0.41
ALB P02768 1/20 0.38
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.35
PRSS1 P07477 5/20 0.34
SPHK1 Q9NYA1 3/20 0.34
F2 P00734 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
TMPRSS6 Q8IU80 2/20 0.33
ST14 Q9Y5Y6 2/20 0.33
PAOX Q6QHF9 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
Synthalin SCHEMBL336302 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL434733 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
Arcaine SCHEMBL29050632 0.97 MEN1 (0.60) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL3069140 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL1923256 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL3072659 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL10728151 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
Arcaine SCHEMBL11414566 0.97 MEN1 (0.60) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
SCHEMBL11882788 0.97 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15
Hydrochloric Acid SCHEMBL21715464 0.94 SMN1; SMN2 (0.64) MEN1KMT2ASMN1; SMN2CYP1A2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11819535-B2 Composition and methods for regulating extracellular matrix accumulation UNIVERSITY HEALTH NETWORK (CA) 2023-11-21 US claimed
EP-2665739-A1 METHODS AND COMPOSITIONS RELATED TO SYNERGISTIC RESPONSES TO ONCOGENIC MUTATIONS THE UNIVERSITY OF ROCHESTER (US) 2013-11-27 EP claimed
US-20120322868-A1 FOOD PRODUCTS, PREPARATION, AND THERAPEUTIC METHODS SCHLOSS JOHN V (US) 2012-12-20 US claimed
WO-2012100248-A1 METHODS AND COMPOSITIONS RELATED TO SYNERGISTIC RESPONSES TO ONCOGENIC MUTATIONS THE UNIVERSITY OF ROCHESTER (US) 2012-07-26 WO claimed
US-20120114670-A1 METHODS AND COMPOSITIONS RELATED TO SYNERGISTIC RESPONSES TO ONCOGENIC MUTATIONS UNIVERSITY OF ROCHESTER (US) 2012-05-10 US claimed
US-20120082659-A1 Methods And Compositions Related To Synergistic Responses To Oncogenic Mutations NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-04-05 US claimed
US-8101744-B2 Isolation and purification of nucleic acids with a solid phase ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2012-01-24 US claimed
WO-2011103577-A1 IMPROVED FOOD PRODUCTS, PREPARATION, AND THERAPEUTIC METHODS SCHLOSS JOHN V (US) 2011-08-25 WO claimed
EP-2196091-B1 Synergistic combinations comprising at least one fungicide and a guanidine salt STRAETMANS HIGH TAC GMBH (DE) 2010-12-08 EP claimed
US-20100285001-A1 Method and Compositions Related to Synergistic Responses to Oncogenic Mutations UNIVERSITY OF ROCHESTER (US) 2010-11-11 US claimed
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine L'OREAL 2005-06-16 US claimed
EP-1532963-A1 Composition for straightening the hair comprising at least one imine not being an hydroxide L'OREAL (FR) 2005-05-25 EP claimed
EP-1532960-A1 Hair styling composition containing a non-hydroxide imine L'OREAL (FR) 2005-05-25 EP claimed
EP-0797442-B1 TREATMENT OF OPTIC NEURITIS MASSACHUSETTS EYE & EAR INFIRM (US) 2003-05-21 EP claimed
JP-2002517462-A 2002-06-18 JP claimed
WO-1999064041-A9 MULTIBINDING AGENTS THAT MODULATE NMDA RECEPTORS ADVANCED MEDICINE INC (US) 2001-05-31 WO claimed
EP-1100519-A1 MULTIBINDING AGENTS THAT MODULATE NMDA RECEPTORS Advanced Medicine, Inc. (US) 2001-05-23 EP claimed
WO-1999064041-A1 MULTIBINDING AGENTS THAT MODULATE NMDA RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO claimed
WO-1998010757-A9 THE USE OF FUNCTIONAL N-METHYL-D-ASPARTATE ANTAGONISTS TO AMELIORATE OR PREVENT AMINOGLYCOSIDE-INDUCED OTOTOXICITY 1998-07-23 WO claimed
WO-1998010757-A2 THE USE OF FUNCTIONAL N-METHYL-D-ASPARTATE ANTAGONISTS TO AMELIORATE OR PREVENT AMINOGLYCOSIDE-INDUCED OTOTOXICITY THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-03-19 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 (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-20120322868-A1 FOOD PRODUCTS, PREPARATION, AND THERAPEUTIC METHODS SLC7A11, CTH, GNMT MEN1 1244/4885KMT2A 2255/4885SMN1; SMN2 2921/4885
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine KRT18, INHA, H1-5 MEN1 237/4885KMT2A 949/4885SMN1; SMN2 3508/4885

“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.