SCHEMBL10070993

SCHEMBL10070993

CCCCOc1cc(N)c(-c2ccccc2)c2cc3c(cc12)OC(OC)O3

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42
TLR8 Q9NR97 3/20 0.36
NCF1 P14598 4/20 0.34
MCHR1 Q99705 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PTPN1 P18031 1/20 0.32
LTA4H P09960 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL10070138 0.89 BCHE (0.36) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL10070479 0.86 PTPN11 (0.40) KDM4EPTPN1CNR2
SCHEMBL10041198 0.85 CDK5 (0.42) KDM4ELTA4H
SCHEMBL10070478 0.83 CDK5 (0.33) BCHEACHE
SCHEMBL10071039 0.80 BCHE (0.31) BCHEACHE
SCHEMBL17733172 0.78 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL4572111 0.78 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL15492793 0.78 CYP1A2 (0.39) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL15452336 0.74 CYP1A2 (0.43) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL13556904 0.74 CYP1A2 (0.42) CYP1A2CYP2C9CYP2C19BCHEACHE

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-20120161089-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-06-28 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-20120161089-A1 CHROMENE COMPOUND CYP8B1, HSD3B2, CYP17A1 CYP1A2 72/4885CYP2C9 443/4885CYP2C19 115/4885

“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.