SCHEMBL359796

SCHEMBL359796

CC(C)CCN1N=C(CN(C)C(=O)O)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
SORT1 Q99523 2/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RAB9A P51151 1/20 0.30
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL359878 0.88 ALDH1A1 (0.32) ALDH1A1GAAMAPTTHRB
SCHEMBL359409 0.87 ALDH1A1 (0.31) ALDH1A1GAA
SCHEMBL360274 0.86 POLB (0.34) ALDH1A1GAAPOLBHPGD
SCHEMBL361729 0.83 ALDH1A1 (0.47) LMNAALDH1A1GAAMAPTTHRB
SCHEMBL10079889 0.82 HTR2C (0.32) LMNA
SCHEMBL359437 0.82 ALDH1A1 (0.52) LMNAALDH1A1GAAMAPTTHRB
SCHEMBL359186 0.81 ALDH1A1 (0.51) LMNAALDH1A1GAAMAPTTHRB
SCHEMBL360189 0.81 NPC1 (0.32) LMNAALDH1A1GAAMAPTTHRB
SCHEMBL360695 0.81 ALDH1A1 (0.51) LMNAALDH1A1GAAMAPTTHRB
SCHEMBL358852 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11312688-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-04-26 US disclosed
US-20200308119-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2020-10-01 US disclosed
US-10723703-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-07-28 US disclosed
US-20190084938-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2019-03-21 US disclosed
US-10183913-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-01-22 US disclosed
US-10087146-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-10-02 US disclosed
US-20180273489-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2018-09-27 US disclosed
US-20170217902-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2017-08-03 US disclosed
US-9663472-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-05-30 US disclosed
EP-2594559-B1 PYRAZOLE COMPOUND SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2016-02-24 EP disclosed
US-20140315971-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2014-10-23 US disclosed
US-8809383-B2 Pyrazole compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-08-19 US disclosed
US-20140031406-A1 PYRAZOLE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-01-30 US disclosed
US-8569353-B2 Pyrazole compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-10-29 US disclosed
EP-2594559-A1 PYRAZOLE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-05-22 EP disclosed
US-20130116296-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2013-05-09 US disclosed
CN-103097357-A Pyrazole compound DAINIPPON SUMITOMO PHARMA CO 2013-05-08 CN disclosed
WO-2012008528-A1 PYRAZOLE COMPOUND 大日本住友製薬株式会社 (JP) 2012-01-19 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 (11 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-20140315971-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-10183913-B2 Pyrazole compound HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20170217902-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-11312688-B2 Pyrazole compound HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20130116296-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20200308119-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-10723703-B2 Pyrazole compound HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20180273489-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20190084938-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-10087146-B2 Pyrazole compound HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885
US-20140031406-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A LMNA 4613/4885TP53 4790/4885SORT1 4048/4885

“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.