SCHEMBL12424663

SCHEMBL12424663

CCCCC1(OCC(C)(C)C)c2ccccc2-c2ccccc2-c2c1cc(O)c1cc3c(cc21)OCO3

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.31
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31
SCN9A Q15858 5/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL12424646 0.87 SCN9A (0.33) HSP90AA1SCN9AGABRA1GABRB2
SCHEMBL12424629 0.81 SCN9A (0.36) HSP90AA1SCN9AGABRA1GABRB2
SCHEMBL12424673 0.74 CNR1 (0.35)
SCHEMBL25836768 0.70 HSP90AA1 (0.36) HSP90AA1
SCHEMBL12424664 0.70 HSP90AA1 (0.35) HSP90AA1
SCHEMBL10018217 0.70 HSP90AA1 (0.37) HSP90AA1
SCHEMBL12424667 0.69 AURKA (0.34) HSP90AA1
SCHEMBL12424598 0.67 CNR2 (0.35) TP53
SCHEMBL25876531 0.66 SCN9A (0.36) HSP90AA1SCN9A
SCHEMBL12424647 0.64 CNR2 (0.32) TP53

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7976739-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2011-07-12 US disclosed
US-7976739-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2011-07-12 US disclosed
US-20100230649-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2010-09-16 US disclosed
US-20100230649-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2010-09-16 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-20100230649-A1 CHROMENE COMPOUND CCNT1, RB1, H1-0 HSP90AA1 4086/4885TP53 931/4885MDM2 4307/4885

“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.