SCHEMBL4064773

SCHEMBL4064773

Oc1ccccc1Cc1cccc(Cc2cccc(O)c2Cc2cccc(Cc3ccccc3O)c2O)c1O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.64
KEAP1 Q14145 1/20 0.47
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
HIF1A Q16665 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
AKR1B1 P15121 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
CA12 O43570 3/20 0.39
CA2 P00918 3/20 0.39
IDO1 P14902 2/20 0.39
CA9 Q16790 2/20 0.38
MPO P05164 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL4063843 0.94 HSPA5 (0.73) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL30874252 0.89 HSPA5 (0.80) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL5852506 0.89 HSPA5 (0.80) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL54577 0.89 HSPA5 (0.80) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL9063157 0.87 HSPA5 (0.76) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL8583175 0.83 HSPA5 (0.76) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL11686142 0.82 HSPA5 (0.67) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL14595234 0.82 HSPA5 (0.67) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL4062308 0.82 HSPA5 (0.67) HSPA5KEAP1CYP2D6TSHRHIF1A
SCHEMBL49745 0.80 HSPA5 (1.00) HSPA5KEAP1CYP2D6TSHRHIF1A

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 HSPA5 4266/4885KEAP1 1098/4885CYP2D6 2877/4885

“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.