SCHEMBL19625534

SCHEMBL19625534

CC(=O)N[C@H](C(=O)O)[C@H](O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
SRC P12931 1/20 0.47
LMNA P02545 4/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADRA2C P18825 2/20 0.44
CHRM2 P08172 1/20 0.44
ADRA1A P35348 1/20 0.44
RGS12 O14924 1/20 0.44
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
PKM P14618 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44

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
SCHEMBL10346709 1.00 CA1 (0.52) CA1CA2SRCLMNAMAPK1
SCHEMBL10346708 1.00 CA1 (0.52) CA1CA2SRCLMNAMAPK1
SCHEMBL10778817 0.86 LMNA (0.42) CA1CA2LMNAKMT2AMEN1
SCHEMBL10778827 0.86 LMNA (0.42) CA1CA2LMNAKMT2AMEN1
SCHEMBL8082651 0.84 BRD4 (0.43) CA1CA2KMT2AMEN1TSHR
SCHEMBL14278787 0.83 SRC (0.48) SRCLMNAMAPK1KMT2AMEN1
SCHEMBL4799364 0.83 SRC (0.48) SRCLMNAMAPK1KMT2AMEN1
SCHEMBL762079 0.83 SRC (0.48) SRCLMNAMAPK1KMT2AMEN1
SCHEMBL10346863 0.82 PTGS1 (0.57) KMT2AMEN1CYP2D6MTNR1AMTNR1B
SCHEMBL10346862 0.82 PTGS1 (0.57) KMT2AMEN1CYP2D6MTNR1AMTNR1B

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 3 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-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 CA1 365/4885CA2 385/4885SRC 1897/4885

“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.