SCHEMBL4217152

SCHEMBL4217152

Cc1cc(C)c(NCC(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)c(C)c1N

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.41
▸ L3MBTL3 Q96JM7 2/20 0.41
▸ ABL1 P00519 2/20 0.40
▸ RIN1 Q13671 2/20 0.40
▸ MASP2 O00187 1/20 0.39
▸ CTSG P08311 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ BRAF P15056 1/20 0.39
▸ PIK3R1 P27986 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CCR5 P51681 1/20 0.37
▸ ATR Q13535 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL4211872 0.89 L3MBTL3 (0.42) ACHEL3MBTL3ABL1RIN1MASP2
SCHEMBL4207523 0.89 CACNA1B (0.46) ABL1
SCHEMBL4212647 0.87 CCR5 (0.39) CCR5
SCHEMBL4211913 0.85 KCNH2 (0.50) CCR5
SCHEMBL4202356 0.83 KMT2A (0.44) ALDH1A1
SCHEMBL4212648 0.82 CCR5 (0.44) ALDH1A1CCR5
SCHEMBL4218442 0.81 MCHR1 (0.44) ALDH1A1
SCHEMBL4218448 0.81 MCHR1 (0.44) ALDH1A1
SCHEMBL4199649 0.80 CCR5 (0.34) ACHEALDH1A1CCR5
SCHEMBL4219947 0.79 CHRM1 (0.38) ALDH1A1SMN1; 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-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US claimed
US-6998401-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof SUNTORY LIMITED (JP) 2006-02-14 — — US claimed
US-20050245574-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-11-03 — — US claimed
US-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US disclosed
US-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US disclosed
US-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US disclosed
US-6998401-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof SUNTORY LIMITED (JP) 2006-02-14 — — US disclosed
US-20050245574-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-11-03 — — US disclosed
EP-1045693-B1 AMINOPHENOXYACETIC ACID DERIVATIVES AS NEUROPROTECTANTS DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-06-30 — — EP disclosed
US-20040063748-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2004-04-01 — — US disclosed
US-6559146-B1 Neuroprotective effects by inducing calbindin D28Kd, one of Ca2+-binding proteins SUNTORY LIMITED (JP) 2003-05-06 — — 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-20050245574-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof CAMK2A, CAMK2B, SLC1A2 ACHE 2352/4885L3MBTL3 4597/4885ABL1 852/4885
US-20040063748-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof FABP7, SLC1A2, CAMK2A ACHE 3021/4885L3MBTL3 4755/4885ABL1 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.

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