SCHEMBL5216889

SCHEMBL5216889

Cc1cc(C)c(NCC(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)c(C)c1N

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 11/20 0.44
▸ LMNA P02545 1/20 0.37
▸ KCNQ2 O43526 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ CCR5 P51681 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SETD2 Q9BYW2 1/20 0.35

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
SCHEMBL5217884 0.88 NPY5R (0.47) NPY5RCHRM4CCR5KDM4E
SCHEMBL5212865 0.83 NPY5R (0.43) NPY5RCHRM4CCR5KDM4EMEN1
SCHEMBL4199649 0.80 CCR5 (0.34) LMNACCR5MEN1KMT2A
SCHEMBL4219947 0.79 CHRM1 (0.38) MEN1KMT2A
SCHEMBL4211913 0.79 KCNH2 (0.50) CCR5MEN1KMT2A
SCHEMBL5212791 0.79 SMN1; SMN2 (0.44) NPY5RLMNAMEN1KMT2A
SCHEMBL4217152 0.79 ACHE (0.41) CCR5
SCHEMBL4202369 0.78 HTR4 (0.40) CCR5
SCHEMBL4212647 0.77 CCR5 (0.39) CCR5KMT2A
SCHEMBL4202356 0.77 KMT2A (0.44) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228367-B1 AMINOPHENOXYACETAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING THEREOF ASUBIO PHARMA CO LTD (JP) 2007-09-26 — — EP disclosed
US-20060178401-A1 Aminophenoxyacetamide derivatives and pharmaceutical composition containing thereof DAIICHI ASUBIO PHARMA CO., LTD. 2006-08-10 — — US disclosed
US-7067533-B2 Aminophenoxyacetamide derivatives and pharmaceutical composition containing thereof DAIICHI ASUBIO PHARMA CO., LTD. (JP) 2006-06-27 — — US disclosed
US-20030139447-A1 Aminophenoxyacetamide derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2003-07-24 — — 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-20030139447-A1 Aminophenoxyacetamide derivatives and pharmaceutical composition containing thereof SCN10A, CAMK2A, CAMK2B NPY5R 582/4885LMNA 3529/4885KCNQ2 454/4885
US-20060178401-A1 Aminophenoxyacetamide derivatives and pharmaceutical composition containing thereof NR0B1, NR0B2, NR4A1 NPY5R 321/4885LMNA 4085/4885KCNQ2 489/4885

“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.

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