SCHEMBL228807

SCHEMBL228807

COc1ccc(C2Cc3cc(OC)cc(NCc4ccc(OCc5ccccc5)cc4)c3C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
MAPK1 P28482 1/20 0.49
BCHE P06276 5/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PPARA Q07869 2/20 0.44
KDM1A O60341 4/20 0.43
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
BLM P54132 1/20 0.41
ATM Q13315 1/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
ACHE P22303 1/20 0.41
F2 P00734 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL227020 0.85 BCHE (0.51) MAPTMAPK1BCHEMEN1KMT2A
SCHEMBL2741778 0.79 TSHR (0.41) MAPTBCHEMEN1KMT2AKDM1A
SCHEMBL227019 0.78 LTA4H (0.41) MAPTMAPK1BCHEMEN1KMT2A
SCHEMBL228763 0.73 MAOB (0.48) MAPTKDM1AMAOAMAOBGAA
SCHEMBL228245 0.69 ALOX12 (0.53) MAPTMAPK1MEN1KMT2AKDM1A
SCHEMBL238255 0.69 KDM1A (0.83) KDM1AMAOAMAOB
SCHEMBL238254 0.69 KDM1A (0.83) KDM1AMAOAMAOB
SCHEMBL791985 0.68 MAOB (0.69) MAPTBCHEMEN1KMT2AMAOA
SCHEMBL27731740 0.68 PPARA (0.53) MAPTBCHEMEN1KMT2APPARA
SCHEMBL15546216 0.67 MAPT (0.64) MAPTBCHEMEN1KMT2AKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
US-8399520-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-03-19 US disclosed
US-20120004315-A1 Selective Estrogen Receptor Modulator RADIUS HEALTH, INC. 2012-01-05 US disclosed
US-7960412-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-06-14 US disclosed
US-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR RADIUS HEALTH, INC. 2009-12-31 US disclosed
US-7612114-B2 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI CO., LTD. (JP) 2006-06-01 US disclosed
EP-1577288-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS Eisai Co., Ltd. (JP) 2005-09-21 EP 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 (3 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-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR ESR1, GPER1, ESR2 MAPT 3989/4885MAPK1 1484/4885BCHE 2880/4885
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer BRCA1, BCR, RCC1 MAPT 2593/4885MAPK1 1633/4885BCHE 2221/4885
US-20120004315-A1 Selective Estrogen Receptor Modulator ESR1, GPER1, ESR2 MAPT 3856/4885MAPK1 1582/4885BCHE 2526/4885

“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.