Physostigmine

Physostigmine

SCHEMBL9988368

CNC(=O)Oc1ccc2c(c1)[C@@]1(C)CCN(C)[C@H]1N2C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHE

The experimentally established mechanism targets of Physostigmine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 14/20 1.00
BCHE P06276 11/20 1.00
KDM4E B2RXH2 7/20 1.00
ALDH1A1 P00352 5/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
CYP2D6 P10635 2/20 1.00
HIF1A Q16665 2/20 1.00
MEN1 O00255 1/20 1.00
CYP1A2 P05177 1/20 1.00
KMT2A Q03164 1/20 1.00
LMNA P02545 1/20 1.00
PTGS1 P23219 1/20 1.00
OPRM1 P35372 1/20 1.00
OPRK1 P41145 1/20 1.00
BLM P54132 1/20 1.00
HRH3 Q9Y5N1 1/20 1.00
HSD17B10 Q99714 2/20 0.92
HPGD P15428 2/20 0.79
NPC1 O15118 1/20 0.76
MAPT P10636 1/20 0.76

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
Physostigmine SCHEMBL29482277 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
(+)-Physostigmine SCHEMBL15677750 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL4104619 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL24044 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL8800695 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL24045 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL13930339 1.00 ACHE (1.00) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL7581686 0.99 ACHE (0.98) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL7581684 0.99 ACHE (0.98) ACHEBCHEKDM4EALDH1A1SMN1; SMN2
Physostigmine SCHEMBL7587896 0.99 ACHE (0.98) ACHEBCHEKDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190054067-A1 COMPOSITIONS AND METHODS FOR TREATING COMPULSIVE-LIKE BEHAVIOR IN A SUBJECT SAINT JOSEPH'S UNIVERSITY 2019-02-21 US disclosed
US-20190054067-A1 COMPOSITIONS AND METHODS FOR TREATING COMPULSIVE-LIKE BEHAVIOR IN A SUBJECT SAINT JOSEPH'S UNIVERSITY 2019-02-21 US disclosed
US-20120010283-A1 MODULATION OF ANXIETY THROUGH BLOCKADE OF ANANDAMIDE HYDROLYSIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-01-12 US disclosed
US-20120010283-A1 MODULATION OF ANXIETY THROUGH BLOCKADE OF ANANDAMIDE HYDROLYSIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-01-12 US disclosed
US-20110319386-A1 NEUROGENESIS BY MUSCARINIC RECEPTOR MODULATION BRAINCELLS INC. (US) 2011-12-29 US disclosed
US-8003693-B2 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-08-23 US disclosed
US-8003693-B2 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-08-23 US disclosed
US-20090048337-A1 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-02-19 US disclosed
US-20090048337-A1 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-02-19 US disclosed
US-7176201-B2 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-02-13 US disclosed
US-7176201-B2 Modulation of anxiety through blockade of anandamide hydrolysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-02-13 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 (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-20090048337-A1 Modulation of anxiety through blockade of anandamide hydrolysis FAAH, FAAH2, CNR2 ACHE 185/4885BCHE 305/4885KDM4E 919/4885
US-20110319386-A1 NEUROGENESIS BY MUSCARINIC RECEPTOR MODULATION CHRNB2, CHAT, CHRNB4 ACHE 18/4885BCHE 42/4885KDM4E 2095/4885
US-20190054067-A1 COMPOSITIONS AND METHODS FOR TREATING COMPULSIVE-LIKE BEHAVIOR IN A SUBJECT CHRNA4, CHRNA5, CHRNE ACHE 42/4885BCHE 300/4885KDM4E 611/4885
US-20120010283-A1 MODULATION OF ANXIETY THROUGH BLOCKADE OF ANANDAMIDE HYDROLYSIS FAAH, FAAH2, CNR2 ACHE 189/4885BCHE 295/4885KDM4E 938/4885

“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.