SCHEMBL1844280

SCHEMBL1844280

CC(C)c1ccc(NC(=O)C2CCCc3ccccc32)cn1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 1/20 0.58
▸ ANO1 Q5XXA6 3/20 0.50
▸ ROCK1 Q13464 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ PLA2G1B P04054 1/20 0.42
▸ ATG4B Q9Y4P1 1/20 0.42
▸ KCNQ2 O43526 1/20 0.42
▸ PSMB5 P28074 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ PRMT5 O14744 1/20 0.41
▸ WDR77 Q9BQA1 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 2/20 0.40

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
SCHEMBL14081068 0.85 CRBN (0.42) CRBNANO1CYP1A2RECQLKMT2A
SCHEMBL1844616 0.82 CRBN (0.52) CRBNANO1ROCK1CYP1A2RECQL
SCHEMBL1845905 0.80 LIPG (0.43) CRBNRAB9A
SCHEMBL9269083 0.78 KMT2A (0.62) CRBNANO1ROCK1CYP1A2RECQL
SCHEMBL20777262 0.73 CRBN (1.00) CRBNANO1ROCK1ALDH1A1
SCHEMBL20773497 0.73 CRBN (1.00) CRBNANO1ROCK1ALDH1A1
SCHEMBL24799237 0.73 ANO1 (0.65) CRBNANO1ROCK1CYP1A2RECQL
SCHEMBL2943977 0.73 BTK (0.54) CRBNANO1
SCHEMBL1843332 0.72 ADAM17 (0.38) ALDH1A1KMT2ARAB9AMEN1
SCHEMBL25875204 0.72 CRBN (0.80) CRBNANO1ROCK1CYP1A2RECQL

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
EP-1318140-B9 NOVEL AMIDE DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2014-05-21 — — EP disclosed
US-8198454-B2 Amide derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-06-12 — — US disclosed
EP-1318140-B1 NOVEL AMIDE DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2011-05-18 — — EP disclosed
US-7855297-B2 Amide derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-12-21 — — US disclosed
US-20100041656-A1 Novel amide derivatives and medicinal use thereof NAKAMURA MITSUBARU 2010-02-18 — — US disclosed
EP-1852431-A1 OPTICALLY ACTIVE TETRAHYDRONAPHTHALENE DERIVATIVE MITSUBISHI PHARMA CORPORATION (JP) 2007-11-07 — — EP disclosed
US-20040138223-A1 Novel amide derivatives and medicinal use thereof ugs MITSUBISHI TANABE PHARMA CORPORATION (JP) 2004-07-15 — — US disclosed
EP-1318140-A1 NOVEL AMIDE DERIVATIVES AND MEDICINAL USE THEREOF UGS Mitsubishi Pharma Corporation (JP) 2003-06-11 — — EP 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-20100041656-A1 Novel amide derivatives and medicinal use thereof C5AR1, C5AR2, C3AR1 CRBN 4872/4885ANO1 4795/4885ROCK1 1156/4885
US-20040138223-A1 Novel amide derivatives and medicinal use thereof ugs C5AR1, C5AR2, C1S CRBN 4873/4885ANO1 4837/4885ROCK1 1713/4885

“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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