SCHEMBL1703167

SCHEMBL1703167

N=C1CCNC(C(=O)O)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.45
GRIA2 P42262 3/20 0.37
CYP2D6 P10635 3/20 0.36
ALOX15 P16050 3/20 0.36
CYP1A2 P05177 3/20 0.36
CYP2C19 P33261 3/20 0.36
LMNA P02545 2/20 0.36
BLM P54132 2/20 0.36
TSHR P16473 2/20 0.36
MEN1 O00255 2/20 0.36
THRB P10828 2/20 0.36
KMT2A Q03164 2/20 0.36
RAB9A P51151 1/20 0.36
PMP22 Q01453 1/20 0.36
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33

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
SCHEMBL16967412 0.77 EGLN1 (0.47) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL15606429 0.77 EGLN1 (0.47) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL532127 0.77 EGLN1 (0.47) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL5765192 0.75 EGLN1 (0.45) EGLN1GRIA2CYP2D6ALOX15CYP1A2
Acetic Acid SCHEMBL28383924 0.72 EGLN1 (0.42) EGLN1GRIA2CYP2D6ALOX15CYP1A2
Acetic Acid SCHEMBL28383926 0.72 EGLN1 (0.42) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL2122649 0.69 GAA (0.54) TSHRNPSR1MAPTGAA
Hydrochloric Acid SCHEMBL18765678 0.68 TSHR (0.57) TSHRMEN1KMT2ANPSR1MAPT
SCHEMBL31743277 0.67 EGLN1 (0.38) EGLN1GRIA2TSHRNPSR1
Trifluoroacetic Acid SCHEMBL5764420 0.67 KDM1A (0.40) EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440526-B1 3-HALO-6-(ARLY)-4-IMINOTETRAHYDROPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2014-11-12 EP disclosed
CN-102459176-B 3-halo-(arly)-4-iminotetrahydropicolinates and application thereof as herbicides DOW AGROSCIENCES LLC (US) 2014-05-21 CN disclosed
US-8598086-B2 3-halo-(arly)-4-iminotetrahydropicolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2013-12-03 US disclosed
EP-2440526-A1 3-HALO-6-(ARLY)-4-IMINOTETRAHYDROPICOLINATES AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2012-04-18 EP disclosed
WO-2010144379-A1 3-HALO-(ARLY)-4-IMINOTETRAHYDROPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2010-12-16 WO disclosed
US-20100311594-A1 3-HALO-(ARLY)-4-IMINOTETRAHYDROPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2010-12-09 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 (1 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-20100311594-A1 3-HALO-(ARLY)-4-IMINOTETRAHYDROPICOLINATES AND THEIR USE AS HERBICIDES HDHD5, ATL3, HCAR3 EGLN1 1294/4885GRIA2 1024/4885CYP2D6 223/4885

“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.