SCHEMBL5444174

SCHEMBL5444174

CN(C)c1ccc2c(c1)C(=O)CC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.46
▸ BRD4 O60885 2/20 0.42
▸ HSD17B10 Q99714 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ TERT O14746 1/20 0.39
▸ APP P05067 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP26A1 O43174 1/20 0.38
▸ MIF P14174 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ HTR7 P34969 1/20 0.38

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
SCHEMBL7237468 0.89 MAOA (0.48) PBRM1ALDH1A1HSD17B10HPGDCYP3A4
SCHEMBL6776955 0.85 CASP1 (0.53) PBRM1ALDH1A1HSD17B10CASP1CASP7
SCHEMBL17080971 0.81 TERT (0.42) PBRM1ALDH1A1HSD17B10HPGDACHE
SCHEMBL14596263 0.77 HTR7 (0.38) ALDH1A1HSD17B10HPGDCYP3A4HIF1A
SCHEMBL4741050 0.76 RXRA (0.47) PBRM1ALDH1A1ACHETSHRMAOA
SCHEMBL3994800 0.75 HSD17B1 (0.63) HSD17B10CASP1CASP7CYP26A1MIF
SCHEMBL7233780 0.75 ACHE (0.48) ALDH1A1ACHEPTGS2APPKDM4E
SCHEMBL7233776 0.75 ACHE (0.48) ALDH1A1ACHEPTGS2APPKDM4E
SCHEMBL10483513 0.74 ALDH1A1 (0.47) ALDH1A1HSD17B10HPGDCYP3A4HIF1A
SCHEMBL11872289 0.74 MAOB (0.56) ALDH1A1HSD17B10HPGDCASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994661-B2 Curable composition, cured product, optical component, lens, and compound FUJIFILM CORPORATION (JP) 2018-06-12 — — US disclosed
US-20170342181-A1 CURABLE COMPOSITION, CURED PRODUCT, OPTICAL COMPONENT, LENS, AND COMPOUND FUJIFILM CORPORATION (JP) 2017-11-30 — — US disclosed
US-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-01-25 — — US disclosed
US-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-01-25 — — US disclosed
US-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-01-25 — — US disclosed
WO-2006020070-A2 INDANYLAMINO URACILS AND THEIR USE AS ANTIOXIDANTS AND NEUROPROTECTANTS TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2006-02-23 — — 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 (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-20170342181-A1 CURABLE COMPOSITION, CURED PRODUCT, OPTICAL COMPONENT, LENS, AND COMPOUND CRYAA, UACA, CRYAB PBRM1 1680/4885ALDH1A1 424/4885BRD4 3002/4885
US-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants OGG1, CBR3, C1R PBRM1 4260/4885ALDH1A1 1798/4885BRD4 3129/4885

“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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