SCHEMBL7797100

SCHEMBL7797100

CCCCCOC[C@H](N)C(=O)OP(=O)(O)Cl

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR5 Q9H1C0 4/20 0.46
LPAR1 Q92633 5/20 0.44
LPAR3 Q9UBY5 5/20 0.44
P2RY10 O00398 6/20 0.44
PLA2G2C Q5R387 2/20 0.41
HTT P42858 1/20 0.41
PLA2G2D Q9UNK4 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
TLR2 O60603 2/20 0.39
LPAR6 P43657 3/20 0.39
LPAR4 Q99677 3/20 0.39
LPAR2 Q9HBW0 3/20 0.39
GPR34 Q9UPC5 2/20 0.39

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
SCHEMBL27579516 0.88 LPAR5 (0.51) LPAR5LPAR1LPAR3P2RY10PLA2G2C
SCHEMBL7795355 0.88 LPAR5 (0.51) LPAR5LPAR1LPAR3P2RY10PLA2G2C
SCHEMBL27554230 0.86 P2RY10 (0.45) LPAR5LPAR1LPAR3P2RY10PLA2G2C
SCHEMBL7027227 0.78 P2RY10 (0.38) P2RY10CYP3A4GPR34
SCHEMBL28954689 0.76 HTT (0.54) LPAR5LPAR1LPAR3P2RY10PLA2G2C
SCHEMBL14174568 0.74 ALDH1A1 (0.47) PLA2G2CHTTCYP1A2CYP3A4CYP2C19
SCHEMBL25354441 0.74 P2RY10 (0.54) LPAR5P2RY10PLA2G2CHTTCYP1A2
SCHEMBL25354445 0.74 P2RY10 (0.54) LPAR5P2RY10PLA2G2CHTTCYP1A2
SCHEMBL12203832 0.73 P2RY10 (0.56) LPAR5P2RY10PLA2G2CHTTCYP1A2
SCHEMBL25055940 0.73 MAPT (0.44) P2RY10PLA2G2CHTTCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010031745-A1 Antiviral purine derivatives UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2001-10-18 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-20010031745-A1 Antiviral purine derivatives PNP, TYMP, MTAP LPAR5 1905/4885LPAR1 1133/4885LPAR3 1997/4885

“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.