SCHEMBL3423971

SCHEMBL3423971

N[C@@H](CCCCC=O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.59
ARG2 P78540 5/20 0.53
ARG1 P05089 3/20 0.53
NOS2 P35228 6/20 0.47
NOS1 P29475 4/20 0.47
CYP1A2 P05177 3/20 0.47
NOS3 P29474 3/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 2/20 0.47
GLA P06280 1/20 0.47
NFKB1 P19838 1/20 0.47
APEX1 P27695 1/20 0.47
GRM8 O00222 1/20 0.46
GRM6 O15303 1/20 0.46
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
GRIK1 P39086 1/20 0.46
GRM5 P41594 1/20 0.46
GRIA1 P42261 1/20 0.46

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
SCHEMBL17262412 1.00 GSR (0.59) GSRARG2ARG1NOS2NOS1
SCHEMBL259006 1.00 GSR (0.59) GSRARG2ARG1NOS2NOS1
SCHEMBL29958570 0.98 GSR (0.57) GSRARG2ARG1NOS2NOS1
SCHEMBL2599185 0.98 GSR (0.57) GSRARG2ARG1NOS2NOS1
SCHEMBL79859 0.93 GSR (0.56) GSRARG2ARG1NOS2NOS1
SCHEMBL2722969 0.93 GSR (0.56) GSRARG2ARG1NOS2NOS1
SCHEMBL198242 0.93 GSR (0.56) GSRARG2ARG1NOS2NOS1
SCHEMBL30463729 0.91 GSR (0.54) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL4956653 0.88 GSR (0.74) GSRARG2ARG1NOS2NOS1
Ornithine SCHEMBL10560893 0.86 GSR (0.64) GSRARG2ARG1NOS2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024006841-A2 COMPOSITIONS FOR WEIGHT LOSS AND CANCER TREATMENT KNOWLEDGE PHARMACEUTICALS INC. (US) 2024-01-04 WO disclosed
US-20220296584-A1 Membrane Active Molecules KNOWLEDGE PHARMACEUTICALS INC. 2022-09-22 US disclosed
EP-3973997-A1 MEMBRANE ACTIVE MOLECULES Branequest, Inc. (US) 2022-03-30 EP disclosed
US-20200375958-A1 MEMBRANE ACTIVE MOLECULES KNOWLEDGE PHARMACEUTICALS INC. 2020-12-03 US disclosed
EP-3615084-A1 MEMBRANE ACTIVE MOLECULES Branequest, Inc. (US) 2020-03-04 EP disclosed
WO-2018200412-A1 MEMBRANE ACTIVE MOLECULES BraneQuest, Inc. (US) 2018-11-01 WO disclosed
US-20180303821-A1 MEMBRANE ACTIVE MOLECULES KNOWLEDGE PHARMACEUTICALS INC. 2018-10-25 US disclosed
US-20170369914-A1 METHODS OF PRODUCING 6-CARBON CHEMICALS USING 2,6-DIAMINOPIMELATE AS PRECURSOR TO 2-AMINOPIMELATE INVISTA NORTH AMERICA S.A.R.L. 2017-12-28 US disclosed
US-9745607-B2 Methods of producing 6-carbon chemicals using 2,6-diaminopimelate as precursor to 2-aminopimelate INVISTA NORTH AMERICA S.A.R.L. (US) 2017-08-29 US disclosed
EP-3143152-A1 METHODS OF PRODUCING 6-CARBON CHEMICALS USING 2,6-DIAMINOPIMELATE AS PRECURSOR TO 2-AMINOPIMELATE Invista Technologies S.à r.l. (CH) 2017-03-22 EP disclosed
US-20150361462-A1 METHODS OF PRODUCING 6-CARBON CHEMICALS USING 2,6-DIAMINOPIMELATE AS PRECURSOR TO 2-AMINOPIMELATE INV NYLON CHEMICALS AMERICAS, LLC 2015-12-17 US disclosed
WO-2015176026-A1 METHODS OF PRODUCING 6-CARBON CHEMICALS USING 2,6-DIAMINOPIMELATE AS PRECURSOR TO 2-AMINOPIMELATE Invista North America S.á.r.l. (US) 2015-11-19 WO disclosed
WO-2010046713-A2 METHODS FOR PREPARING HETEROCYCLIC RINGS ISIS INNOVATION (GB) 2010-04-29 WO disclosed
WO-2010046713-A2 METHODS FOR PREPARING HETEROCYCLIC RINGS ISIS INNOVATION (GB) 2010-04-29 WO 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-20220296584-A1 Membrane Active Molecules GABRP, GRIN3A, GRIN2A GSR 869/4885ARG2 2061/4885ARG1 4334/4885
US-20180303821-A1 MEMBRANE ACTIVE MOLECULES GABRP, GRIN3A, GRIN2A GSR 869/4885ARG2 2061/4885ARG1 4334/4885
US-20200375958-A1 MEMBRANE ACTIVE MOLECULES GABRP, GRIN3A, GRIN2A GSR 869/4885ARG2 2061/4885ARG1 4334/4885

“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.