SCHEMBL4063769

SCHEMBL4063769

Cc1c(O)ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(O)c(C)c3O)c2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.47
ESR2 Q92731 3/20 0.47
TRPA1 O75762 2/20 0.41
ATM Q13315 1/20 0.41
CNR1 P21554 4/20 0.39
CNR2 P34972 4/20 0.39
ALOX15 P16050 3/20 0.39
ALOX12 P18054 1/20 0.39
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
KLF10 Q13118 1/20 0.37
CA2 P00918 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 2/20 0.34
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL8987443 0.85 ESR1 (0.50) ESR1ESR2TRPA1CNR1CNR2
SCHEMBL4055665 0.85 ESR1 (0.47) ESR1ESR2TRPA1ATMCNR1
SCHEMBL4056187 0.82 ESR1 (0.41) ESR1ESR2TRPA1ATMALOX15
SCHEMBL4055015 0.80 ESR1 (0.54) ESR1ESR2ALOX15ALOX12KLF10
SCHEMBL12339902 0.79 ESR1 (0.44) ESR1ESR2TRPA1ATMCNR1
SCHEMBL4463363 0.79 ESR1 (0.44) ESR1ESR2TRPA1ATMCNR1
SCHEMBL11130480 0.78 GABRA1 (0.62) ESR1ESR2TRPA1ATMCNR1
SCHEMBL7938646 0.77 ESR1 (0.46) ESR1ESR2CNR1CNR2ALOX15
SCHEMBL4057111 0.76 ESR1 (0.48) ESR1ESR2TRPA1CNR1CNR2
SCHEMBL29599322 0.76 ESR1 (0.48) ESR1ESR2TRPA1CNR1CNR2

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
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
EP-1375463-A1 OPTICALLY ACTIVE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Kansai Research Institute, Inc. (JP) 2004-01-02 EP disclosed
US-20030211421-A1 Optically active compound and photosensitive resin composition KRI, INC. (JP) 2003-11-13 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-20030211421-A1 Optically active compound and photosensitive resin composition ARCN1, RAD51, PAM ESR1 392/4885ESR2 895/4885TRPA1 553/4885

“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.