SCHEMBL10041198

SCHEMBL10041198

COC1Oc2cc3c(OCc4ccccc4)cc(N)c(-c4ccccc4)c3cc2O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 5/20 0.42
CDK5R1 Q15078 5/20 0.42
GSK3B P49841 5/20 0.42
CDK1 P06493 5/20 0.41
CCNB1 P14635 5/20 0.41
CCNE2 O96020 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
DHFR P00374 1/20 0.35
ALOX5AP P20292 1/20 0.35
ERN1 O75460 1/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LTA4H P09960 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL10041199 0.88 CDK5 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10041195 0.87 CDK5 (0.38) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10070993 0.85 CYP1A2 (0.43) LTA4HKDM4E
SCHEMBL10041197 0.85 ERN1 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10041200 0.80 AKR1B1 (0.35) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10070478 0.78 CDK5 (0.33) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL17736777 0.78 GSK3B (0.45) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL4568721 0.78 GSK3B (0.40) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL18827124 0.77 CDK5 (0.57) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL17736806 0.76 MAPT (0.43) CDK5CDK5R1GSK3BCDK1CCNB1

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 CDK5 2524/4885CDK5R1 1160/4885GSK3B 1900/4885

“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.