SCHEMBL2165481

SCHEMBL2165481

CCOC(=O)C1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
TSHR P16473 4/20 0.67
MAPT P10636 2/20 0.64
HPGD P15428 1/20 0.63
GAA P10253 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LGMN Q99538 1/20 0.60
KDM4E B2RXH2 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
POLB P06746 1/20 0.57
ATM Q13315 1/20 0.56

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
SCHEMBL31458523 0.91 TSHR (0.60) ALDH1A1TSHRMAPTHPGDGAA
SCHEMBL3436315 0.89 ALDH1A1 (0.64) ALDH1A1TSHRMAPTHPGDMEN1
SCHEMBL18914465 0.88 MEN1 (0.65) ALDH1A1TSHRMAPTHPGDGAA
SCHEMBL18914463 0.87 MEN1 (0.64) ALDH1A1TSHRMAPTHPGDGAA
SCHEMBL14804207 0.86 HPGD (0.61) ALDH1A1TSHRMAPTHPGDMEN1
SCHEMBL2080093 0.86 LGMN (0.71) ALDH1A1TSHRMAPTHPGDGAA
SCHEMBL196131 0.86 HPGD (0.61) ALDH1A1TSHRMAPTHPGDMEN1
SCHEMBL18914464 0.85 HPGD (0.60) ALDH1A1TSHRMAPTHPGDMEN1
SCHEMBL17542826 0.85 LGMN (0.59) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL3252309 0.85 HPGD (0.84) ALDH1A1TSHRMAPTHPGDGAA

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-2069316-B1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2015-10-07 EP disclosed
US-8765764-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA, INC. (JP) 2014-07-01 US disclosed
EP-2615086-A1 2,4-Diaminoquinazolines for the treatment of spinal muscular atrophy Families of Spinal Muscular Atrophy (US) 2013-07-17 EP disclosed
US-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA, INC. (JP) 2013-03-28 US disclosed
US-7985755-B2 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-07-26 US disclosed
EP-2069316-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY Families of Spinal Muscular Atrophy (US) 2009-06-17 EP disclosed
US-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2009-02-12 US disclosed
WO-2008016973-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2008-02-07 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-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 ALDH1A1 2060/4885TSHR 2796/4885MAPT 4550/4885
US-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYT1 ALDH1A1 1308/4885TSHR 4604/4885MAPT 715/4885

“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.