SCHEMBL4179482

SCHEMBL4179482

O=C(NCc1ccccc1)N1CC[C@H](OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
FAAH O00519 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MEN1 O00255 1/20 0.50
F2 P00734 1/20 0.48
PRSS1 P07477 1/20 0.48
CYP2C9 P11712 1/20 0.48
EPHX2 P34913 1/20 0.48
CYP2J2 P51589 1/20 0.48
PKM P14618 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
BCHE P06276 1/20 0.46
GRM5 P41594 1/20 0.46
GRM7 Q14831 1/20 0.46
GRM3 Q14832 1/20 0.46

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
SCHEMBL4190497 1.00 KMT2A (0.50) KMT2AFAAHNPSR1MEN1F2
SCHEMBL4179487 1.00 KMT2A (0.50) KMT2AFAAHNPSR1MEN1F2
SCHEMBL4193435 0.82 FAAH (0.43) KMT2AFAAHMEN1EPHX2BCHE
SCHEMBL4193428 0.82 FAAH (0.43) KMT2AFAAHMEN1EPHX2BCHE
SCHEMBL4084898 0.81 POLB (0.45) KMT2AFAAHMEN1EPHX2TDP1
SCHEMBL4084892 0.81 FAAH (0.52) FAAHEPHX2
SCHEMBL4083294 0.81 KMT2A (0.48) KMT2AFAAHMEN1EPHX2TDP1
SCHEMBL4075591 0.79 LMNA (0.51) FAAHPKMTDP1
SCHEMBL4085306 0.79 ALDH1A1 (0.49) KMT2AFAAHMEN1CYP2C9PKM
SCHEMBL4184955 0.78 CNR1 (0.47) FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders VERNALIS RESEARCH LIMITED. (GB) 2009-07-16 US disclosed
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs VERNALIS RESEARCH LIMITED (GB) 2007-07-26 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 (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-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders CNR1, CNR2, GPR119 KMT2A 1168/4885FAAH 116/4885NPSR1 75/4885
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs CNR1, CNR2, GPR119 KMT2A 1714/4885FAAH 216/4885NPSR1 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.