SCHEMBL4667796

SCHEMBL4667796

CN1CCC(Oc2cccc(CNC(=O)c3cccc(-c4ccc(N(C)C)cc4)c3)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC5A7 Q9GZV3 3/20 0.52
AURKA O14965 1/20 0.50
CHRM3 P20309 4/20 0.49
KMT2A Q03164 3/20 0.47
NPC1 O15118 2/20 0.47
APOBEC3A P31941 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ROCK2 O75116 2/20 0.47
MEN1 O00255 2/20 0.46
MMP13 P45452 1/20 0.46
RAB9A P51151 1/20 0.46
WNT1 P04628 1/20 0.45
GSK3B P49841 1/20 0.45
DYRK1A Q13627 1/20 0.45
PABPC1 P11940 1/20 0.44
NAMPT P43490 1/20 0.44
CCR3 P51677 1/20 0.43

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
SCHEMBL4666647 0.86 SLC5A7 (0.54) SLC5A7KMT2ANPC1ROCK2MEN1
SCHEMBL4878514 0.84 SLC5A7 (0.49) SLC5A7AURKACHRM3NPC1ROCK2
SCHEMBL4664201 0.83 MMP13 (0.55) SLC5A7KMT2ANPC1APOBEC3AAPOBEC3G
SCHEMBL4666649 0.82 SLC5A7 (0.54) SLC5A7KMT2ANPC1APOBEC3AAPOBEC3G
SCHEMBL4666174 0.82 ROCK2 (0.59) SLC5A7CHRM3KMT2ANPC1APOBEC3A
SCHEMBL4772536 0.82 SLC5A7 (0.51) SLC5A7CHRM3KMT2ANPC1APOBEC3A
SCHEMBL14026963 0.82 LMNA (0.64) SLC5A7KMT2ANPC1APOBEC3AAPOBEC3G
SCHEMBL4933296 0.81 SLC5A7 (0.60) SLC5A7CHRM3KMT2ANPC1APOBEC3A
Hydrochloric Acid SCHEMBL4666207 0.81 LMNA (0.63) SLC5A7KMT2ANPC1APOBEC3AAPOBEC3G
SCHEMBL4844944 0.80 SLC5A7 (0.48) SLC5A7KMT2ANPC1APOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269275-A1 Novel Mchr1 Antagonists and Their Use for the Treatment of Mchr1 Mediated Conditions and Disorders ASTRAZENECA AB (SE) 2008-10-30 US claimed
EP-1891065-A1 NOVEL MCHR1 ANTAGONISTS AND THEIR USE FOR THE TREATMENT OF MCHR1 MEDIATED CONDITIONS AND DISORDERS AstraZeneca AB (SE) 2008-02-27 EP claimed
WO-2006130075-A1 NOVEL MCHR1 ANTAGONISTS AND THEIR USE FOR THE TREATMENT OF MCHR1 MEDIATED CONDITIONS AND DISORDERS ASTRAZENECA AB (SE) 2006-12-07 WO claimed
US-20080269275-A1 Novel Mchr1 Antagonists and Their Use for the Treatment of Mchr1 Mediated Conditions and Disorders ASTRAZENECA AB (SE) 2008-10-30 US disclosed
US-20080269275-A1 Novel Mchr1 Antagonists and Their Use for the Treatment of Mchr1 Mediated Conditions and Disorders ASTRAZENECA AB (SE) 2008-10-30 US disclosed
US-20080269275-A1 Novel Mchr1 Antagonists and Their Use for the Treatment of Mchr1 Mediated Conditions and Disorders ASTRAZENECA AB (SE) 2008-10-30 US disclosed
EP-1891065-A1 NOVEL MCHR1 ANTAGONISTS AND THEIR USE FOR THE TREATMENT OF MCHR1 MEDIATED CONDITIONS AND DISORDERS AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006130075-A1 NOVEL MCHR1 ANTAGONISTS AND THEIR USE FOR THE TREATMENT OF MCHR1 MEDIATED CONDITIONS AND DISORDERS ASTRAZENECA AB (SE) 2006-12-07 WO 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 (1 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-20080269275-A1 Novel Mchr1 Antagonists and Their Use for the Treatment of Mchr1 Mediated Conditions and Disorders MCHR1, MCHR2, HCRTR1 SLC5A7 854/4885AURKA 4058/4885CHRM3 127/4885

“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.