SCHEMBL5575384

SCHEMBL5575384

COC(=O)c1ccc(Oc2ccc(C=O)c(C)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
ERN1 O75460 4/20 0.50
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
TDP1 Q9NUW8 2/20 0.46
MAPT P10636 2/20 0.45
LMNA P02545 2/20 0.45
GAA P10253 2/20 0.45
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
STS P08842 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL8702460 0.84 ALDH1A1 (0.57) ALDH1A1ERN1CA1CA2TDP1
SCHEMBL21660344 0.84 ALDH1A1 (0.59) ALDH1A1ERN1CA1CA2MAPT
SCHEMBL2558631 0.84 PARP10 (0.59) ALDH1A1ERN1CA1CA2LMNA
SCHEMBL24515546 0.81 ERN1 (0.54) ALDH1A1ERN1CA1CA2TDP1
SCHEMBL4597626 0.81 LMNA (0.53) ALDH1A1ERN1CA1CA2TDP1
SCHEMBL69218 0.79 CA1 (0.75) ALDH1A1CA1CA2TDP1MAPT
SCHEMBL9114889 0.78 LMNA (0.50) ALDH1A1ERN1TDP1MAPTLMNA
SCHEMBL4598157 0.78 ALDH1A1 (0.82) ALDH1A1CA1CA2TDP1MAPT
SCHEMBL4597491 0.77 ALDH1A1 (0.53) ALDH1A1ERN1CA1CA2TDP1
SCHEMBL20772350 0.77 ALDH1A1 (0.58) ALDH1A1CA1CA2TDP1MAPT

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-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 ALDH1A1 3484/4885ERN1 2682/4885CA1 3985/4885

“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.