SCHEMBL3077134

SCHEMBL3077134

CCCCCCO[C@@H]1[C@@H](OCCCCCC)[C@H](OP(=O)(O)OCC(=O)O)[C@@H](OP(=O)(O)OCC(=O)O)[C@@H](OP(=O)(O)OCC(=O)O)[C@H]1OCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.46
LPAR3 Q9UBY5 3/20 0.44
LPAR1 Q92633 2/20 0.44
LPAR2 Q9HBW0 2/20 0.44
AKT1 P31749 5/20 0.40
AKT2 P31751 3/20 0.40
AKT3 Q9Y243 3/20 0.40
PIK3R1 P27986 2/20 0.40
PIK3CA P42336 2/20 0.40
PLCG2 P16885 1/20 0.40
GAB1 Q13480 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
MAPK14 Q16539 1/20 0.38
CETP P11597 3/20 0.38
SMPD1 P17405 1/20 0.37
PAM P19021 2/20 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
SCHEMBL3073934 1.00 GBA1 (0.46) GBA1LPAR3LPAR1LPAR2AKT1
SCHEMBL3082302 0.99 GBA1 (0.44) GBA1LPAR3LPAR1LPAR2AKT1
SCHEMBL3073143 0.99 GBA1 (0.44) GBA1LPAR3LPAR1LPAR2AKT1
SCHEMBL3082560 0.94 GBA1 (0.38) GBA1LPAR3LPAR1LPAR2AKT1
SCHEMBL3082937 0.94 GBA1 (0.38) GBA1LPAR3LPAR1LPAR2AKT1
SCHEMBL3082767 0.88 PDPK1 (0.37) AKT1AKT2AKT3PIK3R1PIK3CA
SCHEMBL3068650 0.88 PDPK1 (0.37) AKT1AKT2AKT3PIK3R1PIK3CA
SCHEMBL10938244 0.80 LPAR3 (0.58) LPAR3LPAR1LPAR2PAM
SCHEMBL3081569 0.79 GBA1 (0.45) GBA1LPAR3LPAR1LPAR2CETP
SCHEMBL3073791 0.79 GBA1 (0.45) GBA1LPAR3LPAR1LPAR2CETP

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 1154/4885LPAR1 2004/4885
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 3383/4885LPAR1 3051/4885

“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.