SCHEMBL3069602

SCHEMBL3069602

CCCCO[C@@H]1[C@@H](OCCCC)[C@H](OP(=O)(O)CC(=O)O)[C@@H](OP(=O)(O)CC(=O)O)[C@@H](OP(=O)(O)CC(=O)O)[C@H]1OCCCC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.36
CETP P11597 3/20 0.35
PDPK1 O15530 1/20 0.34
MTOR P42345 1/20 0.34
PPARG P37231 2/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
LPAR3 Q9UBY5 3/20 0.33
LPAR1 Q92633 2/20 0.33
LPAR2 Q9HBW0 2/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PPP5C P53041 1/20 0.33
PLA2G4B P0C869 1/20 0.33

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
SCHEMBL3078679 1.00 GBA1 (0.36) GBA1CETPPDPK1MTORPPARG
SCHEMBL3077288 0.95 GBA1 (0.42) GBA1CETPPPARGPPARDPPARA
SCHEMBL3078580 0.95 GBA1 (0.42) GBA1CETPPPARGPPARDPPARA
SCHEMBL3073791 0.94 GBA1 (0.45) GBA1CETPPPARGPPARDPPARA
SCHEMBL3081569 0.94 GBA1 (0.45) GBA1CETPPPARGPPARDPPARA
SCHEMBL3075490 0.90 PDPK1 (0.36) CETPPDPK1MTORTSHRTDP1
SCHEMBL3080523 0.90 PDPK1 (0.36) CETPPDPK1MTORTSHRTDP1
SCHEMBL3072802 0.81 GBA1 (0.39) GBA1PDPK1MTORLPAR3LPAR1
SCHEMBL3063334 0.81 GBA1 (0.39) GBA1PDPK1MTORLPAR3LPAR1
SCHEMBL8496685 0.79 PDPK1 (0.47) GBA1PDPK1MTORLPAR3LPAR1

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-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 US claimed
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT SIRÈN MATTI (FI) 2016-03-17 US disclosed
US-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 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 (2 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-20100261682-A1 Method and Means for the Treatment of Cachexia PYGM, GYS1, CPT1B GBA1 2176/4885CETP 1856/4885PDPK1 3190/4885
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT TTPA, LPO, HADHB GBA1 91/4885CETP 338/4885PDPK1 3837/4885

“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.