SCHEMBL19625533

SCHEMBL19625533

CC(=O)NC(C(=O)O)C(O)c1ccc2c(c1)OCO2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.48
HPGD P15428 2/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
MAPK9 P45984 1/20 0.46
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL9501357 1.00 MME (0.48) MMEHPGDPTGS1PTGS2KMT2A
SCHEMBL9502166 0.87 TAS1R3 (0.50) HPGDKMT2AMEN1
SCHEMBL19627057 0.86 PTGS1 (0.49) MMEHPGDPTGS1PTGS2KMT2A
SCHEMBL10346803 0.83 NPC1 (0.53) HPGDPTGS2MAPK9ALDH1A1LMNA
SCHEMBL19614361 0.80 RAB9A (0.55) MMEHPGDKMT2AMEN1MAPK9
SCHEMBL19614362 0.80 RAB9A (0.55) MMEHPGDKMT2AMEN1MAPK9
SCHEMBL13645937 0.79 HPGD (0.67) HPGDKMT2AMEN1ALDH1A1LMNA
SCHEMBL7990464 0.78 MAPK9 (0.54) MMEHPGDPTGS1PTGS2KMT2A
Acetic Acid SCHEMBL10875129 0.78 PTGS1 (0.51) MMEHPGDPTGS1PTGS2KMT2A
Acetic Acid SCHEMBL10942103 0.78 PTGS1 (0.51) MMEHPGDPTGS1PTGS2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9920342-B2 Process for the preparation of Droxidopa DIVI'S LABORATORIES LIMITED 2018-03-20 US disclosed
US-9920342-B2 Process for the preparation of Droxidopa DIVI'S LABORATORIES LIMITED 2018-03-20 US disclosed
US-20170335357-A1 PROCESS FOR THE PREPARATION OF DROXIDOPA DIVI'S LABORATORIES LIMITED (IN) 2017-11-23 US disclosed
US-20170335357-A1 PROCESS FOR THE PREPARATION OF DROXIDOPA DIVI'S LABORATORIES LIMITED (IN) 2017-11-23 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-20170335357-A1 PROCESS FOR THE PREPARATION OF DROXIDOPA DAO, DDO, DNPEP MME 1073/4885HPGD 781/4885PTGS1 4025/4885

“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.