SCHEMBL15064396

SCHEMBL15064396

Cn1c(Oc2ccc(B3OC(C)(C)C(C)(C)O3)cc2)nc2cccnc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.39
LPL P06858 4/20 0.38
LIPG Q9Y5X9 4/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
LMNA P02545 2/20 0.38
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
HDAC5 Q9UQL6 2/20 0.36
HDAC8 Q9BY41 1/20 0.35
USP2 O75604 1/20 0.35
RAB9A P51151 1/20 0.35
DGAT1 O75907 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 2/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL15064879 0.83 HDAC1 (0.40) LPLLIPGLMNAHDAC1HDAC6
SCHEMBL15064395 0.80 SNCA (0.36) SNCALPLLIPGCA1CA2
SCHEMBL569065 0.77 LMNA (0.43) LMNAHDAC1HDAC6HDAC5HDAC8
SCHEMBL5800988 0.74 CA1 (0.49) SNCALPLLIPGCA1CA2
SCHEMBL1699191 0.72 HDAC1 (0.43) LMNAHDAC1HDAC6HDAC5HDAC8
SCHEMBL12045427 0.72 PDE10A (0.46) LMNAHDAC1HDAC6HDAC5HDAC8
SCHEMBL20818352 0.71 CA1 (0.47) SNCALPLLIPGCA1CA2
SCHEMBL2015861 0.71 LPL (0.49) SNCALPLLIPGCA1CA2
SCHEMBL9980752 0.70 PGR (0.43) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL25981404 0.70 LPL (0.48) SNCALPLLIPGCA1CA2

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
EP-2601192-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICALS CO (JP) 2017-03-01 EP disclosed
US-9029536-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-12 US disclosed
US-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-04 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-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS PDE10A, PDE3A, PDE2A SNCA 416/4885LPL 896/4885LIPG 2944/4885

“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.