SCHEMBL3289374

SCHEMBL3289374

CCN(C(C)(CC)CC)P(=O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 12/20 0.34
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP3 P08254 2/20 0.34
MMP8 P22894 2/20 0.34
GGPS1 O95749 7/20 0.31
LPAR3 Q9UBY5 4/20 0.31
LPAR2 Q9HBW0 3/20 0.31
LPAR1 Q92633 2/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL3287592 0.80 FDPS (0.37) FDPSMMP1MMP2MMP3MMP8
SCHEMBL6088197 0.76 FDPS (0.34) FDPSMMP1MMP2MMP3MMP8
SCHEMBL7048475 0.70 MMP1 (0.31) MMP1MMP2MMP3MMP8
Phosphoric Acid SCHEMBL28926960 0.64 FDPS (0.47) FDPSGGPS1LPAR3LPAR2LPAR1
Phosphoric Acid SCHEMBL27351310 0.62 LMNA (0.47) FDPSGGPS1LPAR3LPAR1LMNA
SCHEMBL8529847 0.62 FDPS (0.43) FDPSMMP1MMP2MMP3MMP8
SCHEMBL2961086 0.62
SCHEMBL181792 0.62
SCHEMBL6004329 0.60 TSHR (0.40)
SCHEMBL1921756 0.60 SMPD1 (0.42) FDPSLPAR3LPAR2LPAR1LMNA

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-1889850-B1 NOVEL TRITERPENIC ACID DERIVATIVE AND PREPARATION FOR EXTERNAL APPLICATION FOR SKIN COMPRISING THE SAME POLA CHEM IND INC (JP) 2014-03-05 EP disclosed
US-7718635-B2 Triterpenic acid derivative and preparation for external application for skin comprising the same POLA CHEMICAL INDUSTRIES INC. (JP) 2010-05-18 US disclosed
US-20090075946-A1 NOVEL TRITERPENIC ACID DERIVATIVE AND PREPARATION FOR EXTERNAL APPLICATION FOR SKIN COMPRISING THE SAME POLA CHEMICAL INDUSTRIES INC. (JP) 2009-03-19 US disclosed
EP-1889850-A1 NOVEL TRITERPENIC ACID DERIVATIVE AND PREPARATION FOR EXTERNAL APPLICATION FOR SKIN COMPRISING THE SAME Pola Chemical Industries Inc. (JP) 2008-02-20 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-20090075946-A1 NOVEL TRITERPENIC ACID DERIVATIVE AND PREPARATION FOR EXTERNAL APPLICATION FOR SKIN COMPRISING THE SAME DUSP4, CUTA, DUSP22 FDPS 1445/4885MMP1 2581/4885MMP2 2343/4885

“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.