SCHEMBL9898544

SCHEMBL9898544

COc1ccc2c(O)cc(C(C)(C)O)c(-c3ccc(-c4ccccc4)cc3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 4/20 0.41
KCNH2 Q12809 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
BACE1 P56817 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK8 P45983 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39

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
SCHEMBL6823069 0.82 PDE4B (0.41) ALDH1A1CYP2C9CYP2C19CA1CA2
SCHEMBL15763606 0.81 LMNA (0.39) MEN1KMT2ABACE1POLBALDH1A1
SCHEMBL9899175 0.79 SMN1; SMN2 (0.47) KCNA5KCNH2POLBMAPK8ALDH1A1
SCHEMBL9934896 0.77 ANTXR2 (0.39) ALDH1A1HDAC4HDAC2HDAC8CA1
SCHEMBL9896760 0.77 PLA2G2A (0.53) KCNA5KCNH2MEN1KMT2AMAPK8
SCHEMBL14363733 0.77 KCNA5 (0.50) KCNA5KCNH2MEN1KMT2AL3MBTL1
SCHEMBL26513225 0.76 MEN1 (0.40) MEN1KMT2APOLBL3MBTL1ALDH1A1
SCHEMBL13499832 0.74 KCNA5 (0.48) KCNA5KCNH2MEN1KMT2ABACE1
SCHEMBL3143388 0.74 PRNP (0.39) MEN1KMT2AMAPK8ALDH1A1DPP4
SCHEMBL3150964 0.73 LMNA (0.35) MEN1KMT2APOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9028728-B2 Photochromic materials that include indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 KCNA5 1379/4885KCNH2 687/4885MEN1 4483/4885

“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.