SCHEMBL8436838

SCHEMBL8436838

CCNC1(C(N)=O)CN(CC)C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
CNR1 P21554 6/20 0.33
KDM4E B2RXH2 2/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP2D6 P10635 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
SCHEMBL8436912 0.82 KDM4E (0.46) SMN1; SMN2KDM4EKMT2AALDH1A1CYP2D6
SCHEMBL8443686 0.81 CNR1 (0.42) SMN1; SMN2CNR1KDM4EKMT2AALDH1A1
SCHEMBL8443208 0.78 ALDH1A1 (0.47) SMN1; SMN2KDM4EKMT2AALDH1A1CYP2D6
SCHEMBL8254729 0.78 CNR1 (0.33) CNR1KDM4EKMT2A
SCHEMBL13804337 0.77
SCHEMBL24946123 0.72 KDM4E (0.38) SMN1; SMN2CNR1KDM4EKMT2AALDH1A1
SCHEMBL3554211 0.72 KMT2A (0.42) CNR1KDM4EKMT2A
SCHEMBL12918527 0.72 CNR1 (0.43) CNR1KDM4EKMT2AALDH1A1CYP2D6
SCHEMBL8444067 0.71 SMN1; SMN2 (0.41) SMN1; SMN2
Hydrochloric Acid SCHEMBL4837442 0.71 KDM4E (0.41) CNR1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329658-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC (US) 2008-02-12 US disclosed
US-20070275964-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF PFIZER, INC. 2007-11-29 US disclosed
US-7268133-B2 Cannabinoid receptor ligands and uses thereof PFIZER, INC. PATENT DEPARTMENT (US) 2007-09-11 US disclosed
US-7232823-B2 Cannabinoid receptor ligands and uses thereof PFIZER, INC. (US) 2007-06-19 US disclosed
US-7176210-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC. (US) 2007-02-13 US disclosed
US-20040214837-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC. 2004-10-28 US disclosed
US-20040157839-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2004-08-12 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 (3 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-20040157839-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 SMN1; SMN2 3678/4885CNR1 1/4885KDM4E 3361/4885
US-20040214837-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 SMN1; SMN2 3678/4885CNR1 1/4885KDM4E 3361/4885
US-20070275964-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF CNR1, CNR2, GPR18 SMN1; SMN2 3902/4885CNR1 1/4885KDM4E 3352/4885

“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.