Proline

Proline

SCHEMBL3226745

NCC(=O)O.O=C(O)[C@@H]1CC(O)CN1.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

The experimentally established mechanism targets of Proline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
ALOX15 P16050 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIA1 P42261 1/20 0.37
GRIA2 P42262 1/20 0.37
GRIA3 P42263 1/20 0.37
GRIA4 P48058 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37

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
Proline SCHEMBL4406680 1.00 CYP1A2 (0.39) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL1196248 1.00 CYP1A2 (0.39) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL28898904 1.00 CYP1A2 (0.39) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL6690175 0.91 SMYD3 (0.38) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL28396348 0.91 SMYD3 (0.38) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL11221271 0.91 SMYD3 (0.38) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL1642880 0.91 CYP1A2 (0.46) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL14661418 0.91 CYP1A2 (0.46) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Proline SCHEMBL6810009 0.91 CYP1A2 (0.46) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3
Glycine SCHEMBL1537355 0.87 CYP2D6 (0.48) CYP1A2ALOX15CYP2C19CYP2D6SLC1A3

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
WO-2021110834-A2 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH ZURICH (CH) 2021-06-10 WO claimed
EP-3831820-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH Zurich (CH) 2021-06-09 EP claimed
US-20230104758-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH ZURICH (CH) 2023-04-06 US disclosed
WO-2021110834-A2 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH ZURICH (CH) 2021-06-10 WO disclosed
EP-3831820-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH Zurich (CH) 2021-06-09 EP disclosed
US-8541471-B2 Water-soluble strontium salts for use in treatment of cartilage and/or bone conditions OSTEOLOGIX A/S (DK) 2013-09-24 US disclosed
US-20100048697-A1 WATER-SOLUBLE STRONTIUM SALTS FOR USE IN TREATMENT OF CARTILAGE AND/OR BONE CONDITIONS HANSEN CHRISTIAN 2010-02-25 US disclosed
US-7595342-B2 Water-soluble strontium salts for use in treatment of cartilage and/or bone conditions OSTEOLOGIX A/S (DK) 2009-09-29 US disclosed
US-20060122274-A1 Water-soluble strontium salts for use in treatment of cartilage and/or bone conditions OSTEOLOGIX A/S (DK) 2006-06-08 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-20230104758-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING DAO, LOX, AOC2 CYP1A2 179/4885ALOX15 434/4885CYP2C19 641/4885

“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.