SCHEMBL5528131

SCHEMBL5528131

C=CN(CC(=O)O)C(C)N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
BLM P54132 2/20 0.38
SLC6A3 Q01959 2/20 0.38
TSHR P16473 2/20 0.38
CYP2C19 P33261 2/20 0.38
MEN1 O00255 1/20 0.38
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
KMT2A Q03164 1/20 0.38
GABRP O00591 4/20 0.37
GABRD O14764 4/20 0.37
GABRA1 P14867 4/20 0.37
GABRB1 P18505 4/20 0.37
GABRG2 P18507 4/20 0.37
GABRB3 P28472 4/20 0.37
GABRA5 P31644 4/20 0.37
GABRA3 P34903 4/20 0.37
GABRA2 P47869 4/20 0.37
GABRB2 P47870 4/20 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
SCHEMBL1049789 0.74 KMT2A (0.34) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL3076022 0.72 SLC6A2 (0.33) SLC6A2SLC6A4BLMSLC6A3TSHR
Hydrochloric Acid SCHEMBL4943209 0.72 KMT2A (0.33) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL3844414 0.72 GABRP (0.42) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL676800 0.72 GABRP (0.42) GABRPGABRDGABRA1GABRB1GABRG2
Hydrochloric Acid SCHEMBL9406488 0.70 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27713478 0.68 GRIK1 (0.33) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL17137740 0.68 GRIK1 (0.33) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL25417579 0.67 DPP4 (0.33) SLC6A2SLC6A4BLMSLC6A3TSHR
SCHEMBL8076843 0.67

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-101233860-B Method for preparing soybean drought resisting yield increasing modifying agent and uses UNIV JILIN NORMAL 2010-09-29 CN claimed
CN-101233860-A Method for preparing soybean drought resisting yield increasing modifying agent and use UNIV JILIN NORMAL (CN) 2008-08-06 CN claimed
CN-112655758-B Application of radix glycyrrhizae extract in preparation of fruit and vegetable preservative 广西壮族自治区药用植物园 2024-02-27 CN disclosed
US-20210219546-A1 METHODS OF TREATING CROP PLANTS ALTER DOMUS US LLC 2021-07-22 US disclosed
EP-3294052-A1 METHODS OF TREATING CROP PLANTS Agrofresh, Inc. (US) 2018-03-21 EP disclosed
WO-2016182995-A1 METHODS OF TREATING CROP PLANTS AGROFRESH INC (US) 2016-11-17 WO disclosed
US-20150282479-A1 METHODS OF TREATING CROP PLANTS AGROFRESH, INC. 2015-10-08 US disclosed
US-9055741-B2 Contacting crop plants with compositions ROHM AND HAAS COMPANY (US) 2015-06-16 US disclosed
EP-1856976-B1 Contacting crop plants with compositions ROHM & HAAS (US) 2014-09-03 EP disclosed
CN-101233860-B Method for preparing soybean drought resisting yield increasing modifying agent and uses UNIV JILIN NORMAL 2010-09-29 CN disclosed
CN-101233860-A Method for preparing soybean drought resisting yield increasing modifying agent and use UNIV JILIN NORMAL (CN) 2008-08-06 CN disclosed
EP-1856976-A2 Contacting crop plants with compositions Rohm and Haas Company (US) 2007-11-21 EP disclosed
US-20070265166-A1 Contacting crop plants with compositions ALTER DOMUS US LLC 2007-11-15 US 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 (3 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-20070265166-A1 Contacting crop plants with compositions PIN1, MYB, CROCC SLC6A2 4858/4885SLC6A4 4768/4885BLM 1554/4885
US-20150282479-A1 METHODS OF TREATING CROP PLANTS CYCS, NOP2, CNPY3 SLC6A2 4226/4885SLC6A4 3988/4885BLM 2603/4885
US-20210219546-A1 METHODS OF TREATING CROP PLANTS CYCS, NOP2, CNPY3 SLC6A2 4226/4885SLC6A4 3988/4885BLM 2603/4885

“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.