SCHEMBL4895931

SCHEMBL4895931

CN1CC[C@@H](O)[C@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 2/20 0.32
GBA1 P04062 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
PMP22 Q01453 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31

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
SCHEMBL17795772 1.00 TDP1 (0.36) TDP1ALDH1A1TSHRGBA1GABRP
SCHEMBL5076199 1.00 TDP1 (0.36) TDP1ALDH1A1TSHRGBA1GABRP
SCHEMBL4648895 1.00 TDP1 (0.36) TDP1ALDH1A1TSHRGBA1GABRP
SCHEMBL204261 1.00 TDP1 (0.36) TDP1ALDH1A1TSHRGBA1GABRP
Hydrochloric Acid SCHEMBL143429 0.98 TDP1 (0.39) TDP1ALDH1A1TSHRGBA1GABRP
SCHEMBL10076954 0.84 GBA1 (0.31) TDP1GBA1
SCHEMBL21515903 0.84 GBA1 (0.31) TDP1GBA1
SCHEMBL21514826 0.84 GBA1 (0.31) TDP1GBA1
SCHEMBL16845501 0.82 SMN1; SMN2 (0.35) GBA1SMN1; SMN2
SCHEMBL26431341 0.82 GBA1 (0.30) TSHRGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005065675-A1 METHOD OF TREATMENT PREMACS INTERNATIONAL PTY. LTD. (AU) 2005-07-21 WO claimed
WO-2023214576-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS 中外製薬株式会社 2023-11-09 WO disclosed
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors SALAMA ZOSER B 2008-07-24 US disclosed
US-20080125319-A1 Treatment of plants and plant propagation materials with an antioxidant to improve plant health and/or yield MONSANTO TECHNOLOGY, LLC (US) 2008-05-29 US disclosed
EP-1711462-A1 PROLINE DERIVATIVES USED AS PHARMACEUTICAL ACTIVE INGREDIENTS FOR THE TREATMENT OF TUMOURS Salama, Zoser B. nat.rer.Dr. (DE) 2006-10-18 EP disclosed
WO-2005065675-A1 METHOD OF TREATMENT PREMACS INTERNATIONAL PTY. LTD. (AU) 2005-07-21 WO disclosed
WO-2005058816-A1 PROLINE DERIVATIVES USED AS PHARMACEUTICAL ACTIVE INGREDIENTS FOR THE TREATMENT OF TUMOURS SALAMA ZOSER B (DE) 2005-06-30 WO disclosed
US-20040259732-A1 Treatment of plants and plant propagation materials with an antioxidant to improve plant health and/or yield MONSANTO TECHNOLOGY, L.L.C. 2004-12-23 US disclosed
WO-2004095926-A2 TREATMENT OF PLANTS AND PLANT PROPAGATION MATERIALS WITH AN ANTIOXIDANT TO IMPROVE PLANT HEALTH AND/OR YIELD MONSANTO TECHNOLOGY, LLC (US) 2004-11-11 WO disclosed
EP-1188055-B1 LABORATORY EXAMINATION OF A BODY FLUID OR TISSUE SAMPLE HOERRMANN WILHELM (DE) 2004-04-14 EP disclosed
EP-1188055-A2 LABORATORY EXAMINATION OF A BODY FLUID OR TISSUE SAMPLE Hoerrmann, Wilhelm, Dr. (DE) 2002-03-20 EP disclosed
CN-1275051-A Method for improving the freezing tolerance of plant UNIV DU QUEBEC A MONTREAL (CA) 2000-11-29 CN disclosed
WO-2000067022-A2 LABORATORY EXAMINATION OF A BODY FLUID OR TISSUE SAMPLE HOERRMANN WILHELM (DE) 2000-11-09 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 (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-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors PREP, PRAP1, VHL TDP1 2885/4885ALDH1A1 1543/4885TSHR 4390/4885

“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.