SCHEMBL2182135

SCHEMBL2182135

CC(=O)c1cc(B(O)O)cs1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TP53 P04637 1/20 0.52
GSK3B P49841 1/20 0.38
POLB P06746 2/20 0.37
HPGD P15428 1/20 0.37
DAO P14920 1/20 0.36
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
CA2 P00918 1/20 0.32
LMNA P02545 2/20 0.31
CLK1 P49759 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 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
SCHEMBL560732 0.81 DAO (0.52) MAPTDAOCES2CES1KDM4E
SCHEMBL9974183 0.79 CTPS1 (0.40) MAPTNPSR1POLBHPGDDAO
SCHEMBL23092955 0.74 ALDH1A1 (0.37) DAOALDH1A1
SCHEMBL361988 0.74 ALDH1A1 (0.40) MAPTGSK3BPOLBHPGDCA2
SCHEMBL1612962 0.71
SCHEMBL3450 0.71
SCHEMBL461797 0.71 ALDH1A1 (0.36) MAPTPOLBLMNAALDH1A1L3MBTL1
SCHEMBL1665488 0.70
SCHEMBL3248570 0.70
SCHEMBL21963324 0.70

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
US-9303033-B2 Pyrazolopyrimidines and related heterocycles as CK2 inhibitors SENHWA BIOSCIENCES, INC. (TW) 2016-04-05 US disclosed
US-8476300-B2 Selective estrogen receptor modulator for the treatment of osteoarthritis ELI LILLY AND COMPANY (US) 2013-07-02 US disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 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-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ESRRA, GPER1, ESR2 MAPT 3514/4885NPSR1 156/4885TP53 881/4885

“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.