SCHEMBL3086913

SCHEMBL3086913

CCCCCO[C@@H]1[C@@H](OCCCCC)[C@H](OP(=O)(O)CO)[C@@H](OP(=O)(O)CO)[C@@H](OP(=O)(O)CO)[C@H]1OCCCCC

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.46
LPAR3 Q9UBY5 10/20 0.43
LPAR2 Q9HBW0 6/20 0.43
LPAR1 Q92633 2/20 0.43
PLCG2 P16885 1/20 0.36
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL3088916 1.00 GBA1 (0.46) GBA1LPAR3LPAR2LPAR1PLCG2
SCHEMBL3078423 0.98 GBA1 (0.49) GBA1LPAR3LPAR2LPAR1PLCG2
SCHEMBL3075776 0.98 GBA1 (0.49) GBA1LPAR3LPAR2LPAR1PLCG2
SCHEMBL3072802 0.95 GBA1 (0.39) GBA1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL3063334 0.95 GBA1 (0.39) GBA1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL3081102 0.87 PDPK1 (0.35) LPAR3LPAR2LPAR1
SCHEMBL3078675 0.87 PDPK1 (0.35) LPAR3LPAR2LPAR1
SCHEMBL3080816 0.84 LPAR3 (0.52) GBA1LPAR3LPAR2LPAR1
SCHEMBL3086336 0.84 LPAR3 (0.52) GBA1LPAR3LPAR2LPAR1
SCHEMBL7751818 0.84 LPAR3 (0.52) GBA1LPAR3LPAR2LPAR1

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 2176/4885LPAR3 1154/4885LPAR2 1904/4885
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT TTPA, LPO, HADHB GBA1 91/4885LPAR3 3383/4885LPAR2 3067/4885

“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.