SCHEMBL3081571

SCHEMBL3081571

CCN(c1ccccc1)C(O)(O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
GLA P06280 1/20 0.50
TSHR P16473 1/20 0.50
NR1H2 P55055 3/20 0.43
NR1H3 Q13133 3/20 0.43
KMT2A Q03164 6/20 0.42
MEN1 O00255 4/20 0.42
LMNA P02545 3/20 0.42
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
TP53 P04637 2/20 0.41
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 1/20 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
SCHEMBL16180258 0.77 ALDH1A1 (0.46) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL27837797 0.77 ALDH1A1 (0.46) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL11748534 0.76 TSHR (0.44) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL15648369 0.75 NR1H2 (0.45) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL16374021 0.74 ALDH1A1 (0.47) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL1887926 0.74 LMNA (0.44) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL2672712 0.73 TSHR (0.43) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL1258398 0.71 TSHR (0.42) ALDH1A1GLATSHRNR1H2NR1H3
SCHEMBL14691647 0.71 NPSR1 (0.44) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL16858007 0.69 KMT2A (0.46) ALDH1A1GLATSHRNR1H2NR1H3

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
EP-2604697-B1 Triprenyl phenol compounds, process for their production and use as thrombolysis enhancer UNIV TOKYO AGRICULTURE & TECHNOLOGY TLO CO LTD (JP) 2015-07-01 EP claimed
US-7777073-B2 Topical delivery system for antiaging and skin whitening agents BIODERM RESEARCH (US) 2010-08-17 US disclosed
US-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents BIODERM RESEARCH (US) 2009-03-19 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-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents TYR, MMP17, MMP1 ALDH1A1 567/4885GLA 33/4885TSHR 2624/4885

“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.