SCHEMBL4224310

SCHEMBL4224310

C=CC(=O)N(CC(=O)O)c1c[nH]c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
MITF O75030 1/20 0.47
GSTO1 P78417 1/20 0.43
ADAM17 P78536 1/20 0.43
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
HTR1A P08908 2/20 0.40
ADRA2A P08913 2/20 0.40
ADRA2B P18089 2/20 0.40
ADRA2C P18825 2/20 0.40

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
SCHEMBL468298 0.82 LMNA (0.52) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL10991862 0.80 ALDH1A1 (0.65) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL27462408 0.76 ALDH1A1 (0.52) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL10981584 0.75 ALDH1A1 (0.44) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL26624956 0.74 GSTO1 (0.49) TDP1GSTO1
SCHEMBL10980705 0.73 ALDH1A1 (0.53) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL2992708 0.73 GSTO1 (0.54) ALDH1A1MEN1KMT2AGSTO1HTT
SCHEMBL20314806 0.73 GSTO1 (0.48) TDP1GSTO1LMNA
SCHEMBL17666019 0.73 BCL2A1 (0.56) TDP1GSTO1HPGD
SCHEMBL17666071 0.73 PSMB5 (0.51) ALDH1A1RAB9AKMT2ATDP1GSTO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115616227-B Use of indole-3-acryloylglycine detection reagent, and kit and system for diagnosis or auxiliary diagnosis of chronic obstructive disease 四川大学华西医院 2023-05-16 CN claimed
CN-115616227-A Application of indole-3-acryloylglycine detection reagent, kit and system for diagnosing or assisting in diagnosing chronic obstructive pulmonary disease 四川大学华西医院 2023-01-17 CN claimed
CN-115616227-B Use of indole-3-acryloylglycine detection reagent, and kit and system for diagnosis or auxiliary diagnosis of chronic obstructive disease 四川大学华西医院 2023-05-16 CN disclosed
CN-115616227-B Use of indole-3-acryloylglycine detection reagent, and kit and system for diagnosis or auxiliary diagnosis of chronic obstructive disease 四川大学华西医院 2023-05-16 CN disclosed
CN-115616227-B Use of indole-3-acryloylglycine detection reagent, and kit and system for diagnosis or auxiliary diagnosis of chronic obstructive disease 四川大学华西医院 2023-05-16 CN disclosed
CN-115616227-A Application of indole-3-acryloylglycine detection reagent, kit and system for diagnosing or assisting in diagnosing chronic obstructive pulmonary disease 四川大学华西医院 2023-01-17 CN disclosed
CN-115616227-A Application of indole-3-acryloylglycine detection reagent, kit and system for diagnosing or assisting in diagnosing chronic obstructive pulmonary disease 四川大学华西医院 2023-01-17 CN disclosed
CN-115616227-A Application of indole-3-acryloylglycine detection reagent, kit and system for diagnosing or assisting in diagnosing chronic obstructive pulmonary disease 四川大学华西医院 2023-01-17 CN disclosed
US-20090028796-A1 PESTICIDAL COMPOSITION COMPRISING INDOLE DERIVATES Max-Planck-Gesellschaft zur Förderung der Wissenschaften e. V. (DE) 2009-01-29 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-20090028796-A1 PESTICIDAL COMPOSITION COMPRISING INDOLE DERIVATES IDO1, IDO2, INMT ALDH1A1 2643/4885NPC1 4509/4885RAB9A 4396/4885

“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.