SCHEMBL4208064

SCHEMBL4208064

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

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ HTR2A P28223 3/20 0.41
▸ HTR2C P28335 3/20 0.41
▸ HTR2B P41595 3/20 0.41
▸ SIGMAR1 Q99720 3/20 0.41
▸ DRD2 P14416 2/20 0.41
▸ MCHR1 Q99705 4/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CCR5 P51681 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ANXA2 P07355 1/20 0.39
▸ S100A10 P60903 1/20 0.39

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
SCHEMBL4202747 0.90 ALDH1A1 (0.42) ALDH1A1KDM4EPKMMCHR1SMN1; SMN2
SCHEMBL4199704 0.85 POLB (0.45) ALDH1A1HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL4199707 0.85 POLB (0.45) ALDH1A1HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL5881690 0.84 ALDH1A1 (0.42) ALDH1A1HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL4218054 0.83 MCHR1 (0.52) ALDH1A1KDM4EMCHR1GAAUSP2
SCHEMBL4368100 0.83 OPRM1 (0.48) SIGMAR1DRD2CCR5MEN1KMT2A
SCHEMBL13928759 0.81 FFAR2 (0.42) CCR5MEN1KMT2A
SCHEMBL13928715 0.81 DRD4 (0.43) ALDH1A1KDM4EDRD2SMN1; SMN2CCR5
SCHEMBL4218452 0.80 CCR5 (0.39) CCR5
SCHEMBL4217091 0.80 DRD2 (0.40) DRD2CCR5

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-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 ALDH1A1 1522/4885KDM4E 1253/4885PKM 1108/4885
US-20040063748-A1 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof FABP7, SLC1A2, CAMK2A ALDH1A1 1079/4885KDM4E 1506/4885PKM 1552/4885

“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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