SCHEMBL7080561

SCHEMBL7080561

CC(C)c1ccc(-c2cc(O)cc(O)c2)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
SLC6A2 P23975 2/20 0.53
HTR2B P41595 2/20 0.53
TRPA1 O75762 1/20 0.53
CHRM1 P11229 1/20 0.53
ADRA1A P35348 1/20 0.53
ABL1 P00519 3/20 0.46
ABCB1 P08183 3/20 0.46
BCR P11274 3/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SENP8 Q96LD8 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
SCHEMBL16528005 0.89 LMNA (0.64) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL7081272 0.84 CA1 (0.50) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL17878569 0.80 ALOX5 (0.57) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL383417 0.76 LMNA (0.64) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL29446964 0.76 LMNA (0.64) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL25494360 0.76 RXRA (0.54) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL19334617 0.76 LMNA (0.48) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL25092816 0.74 TRPA1 (0.43) LMNASLC6A2HTR2BTRPA1CHRM1
Resorcinol SCHEMBL23922720 0.73 TYR (0.56) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL25420702 0.73 APP (0.74) ABL1ABCB1BCRTP53APP

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-20030139479-A1 Non-halogenated biphenyl triol compounds, antimicrobial compositions containing the same, and methods of using the same WARNER-LAMBERT COMPANY 2003-07-24 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-20030139479-A1 Non-halogenated biphenyl triol compounds, antimicrobial compositions containing the same, and methods of using the same AS3MT, PTPN1, NONO LMNA 4693/4885SLC6A2 3535/4885HTR2B 3658/4885

“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.