SCHEMBL2019929

SCHEMBL2019929

CN(C)C(C)(C)Cn1ccc(N)n1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL12574514 0.80 GAA (0.35) ALDH1A1L3MBTL1
SCHEMBL223674 0.78 ALDH1A1 (0.42) ALDH1A1TDP1MEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL1079274 0.76 ALDH1A1 (0.41) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL1081864 0.75 ALDH1A1 (0.41) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL23582744 0.72 ALDH1A1 (0.39) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL3935286 0.71 ALDH1A1 (0.38) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL753436 0.70 ALDH1A1 (0.42) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL1712315 0.70 ALDH1A1 (0.37) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL23582300 0.69 ALDH1A1 (0.36) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL14556270 0.69 HIF1A (0.39) ALDH1A1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105315224-B Cyclopentylacrylic acid amide derivative 杏林制药株式会社 2018-04-10 CN disclosed
US-9452977-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2016-09-27 US disclosed
US-9452977-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2016-09-27 US disclosed
CN-102089291-B Cyclopentyl acrylamide derivative 杏林制药株式会社 2016-08-17 CN disclosed
CN-105315224-A Cyclopentylacrylamide derivative KYORIN SEIYAKU KK 2016-02-10 CN disclosed
EP-2275414-B1 CYCLOPENTYLACRYLAMIDE DERIVATIVE KYORIN SEIYAKU KK (JP) 2015-06-10 EP disclosed
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2015-04-16 US disclosed
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2015-04-16 US disclosed
US-8946440-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-02-03 US disclosed
US-8946440-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-02-03 US disclosed
US-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2011-06-30 US disclosed
US-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2011-06-30 US disclosed
CN-102089291-A Cyclopentyl acrylamide derivative TEIJIN PHARMA LTD 2011-06-08 CN 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-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 ALDH1A1 606/4885TDP1 4684/4885MEN1 2643/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 ALDH1A1 606/4885TDP1 4684/4885MEN1 2643/4885

“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.