SCHEMBL2960170

SCHEMBL2960170

CCCCC(CC)CC(CC(CC)CCCC)C(C)(O)P(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.49
CYP3A4 P08684 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 3/20 0.41
CA2 P00918 2/20 0.39
GGPS1 O95749 6/20 0.38
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 2/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL2962707 0.82 FDPS (0.63) FDPSGGPS1
SCHEMBL9929470 0.78 FDPS (0.42) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL5548513 0.74 CYP3A4 (0.46) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL5551648 0.73 FDPS (0.63) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL2029824 0.72 CA2 (0.44) CYP3A4L3MBTL1ALDH1A1CA2TDP1
Etidronic Acid SCHEMBL10522451 0.72 FDPS (0.44) FDPSCYP3A4L3MBTL1ALDH1A1CA2
Etidronic Acid SCHEMBL10522231 0.72 ALDH1A1 (0.61) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL8548552 0.72 CYP3A4 (0.47) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL2469449 0.72 CYP3A4 (0.47) FDPSCYP3A4L3MBTL1ALDH1A1CA2
SCHEMBL2775263 0.72 FDPS (0.50) FDPSCYP3A4L3MBTL1ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1810975-B1 METHOD FOR PRODUCING PHOSPHONATES HAVING AN ALCOHOLIC HYDROXY GROUP DAIHACHI CHEM IND (JP) 2013-07-31 EP disclosed
US-7772440-B2 Process for preparing phosponates having alcoholic hydroxyl group DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-08-10 US disclosed
US-20090062568-A1 PROCESS FOR PREPARING PHOSPHONATES HAVING ALCOHOLIC HYDROXYL GROUP DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2009-03-05 US disclosed
EP-1810975-A1 METHOD FOR PRODUCING PHOSPHONATE HAVING ALCOHOLIC HYDROXY GROUP DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-07-25 EP 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-20090062568-A1 PROCESS FOR PREPARING PHOSPHONATES HAVING ALCOHOLIC HYDROXYL GROUP PHOSPHO1, ADH1C, ADH1A FDPS 528/4885CYP3A4 1057/4885L3MBTL1 4378/4885

“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.