SCHEMBL229492

SCHEMBL229492

COc1cccc(Cc2ccc(OC)cc2Oc2ccc(OCc3ccccc3)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.58
ABCB1 P08183 4/20 0.54
HTR1A P08908 2/20 0.54
DRD2 P14416 2/20 0.54
BCHE P06276 3/20 0.53
TDP1 Q9NUW8 1/20 0.49
CSF1R P07333 1/20 0.48
PDGFRB P09619 1/20 0.48
FLT4 P35916 1/20 0.48
FLT3 P36888 1/20 0.48

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
SCHEMBL229167 0.85 MTNR1A (0.48) MAOB
SCHEMBL27563776 0.82 MAOB (0.57) MAOBABCB1HTR1ADRD2TDP1
SCHEMBL28050638 0.82 ABCB1 (0.56) MAOBABCB1HTR1ADRD2
SCHEMBL228627 0.82 MAOB (0.58) MAOBABCB1HTR1ADRD2BCHE
Phosphine SCHEMBL28050726 0.81 ABCB1 (0.55) MAOBABCB1HTR1ADRD2
SCHEMBL13263642 0.79 MAOB (0.79) MAOBABCB1HTR1ADRD2BCHE
SCHEMBL229011 0.77 LTA4H (0.72) ABCB1DRD2
SCHEMBL27510940 0.76 ABCB1 (0.59) MAOBABCB1HTR1ADRD2
SCHEMBL3300286 0.76 LTA4H (0.58)
SCHEMBL8845456 0.75 LTA4H (0.63) MAOBABCB1BCHE

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 MAOB 3449/4885ABCB1 2543/4885HTR1A 716/4885
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 MAOB 4319/4885ABCB1 3575/4885HTR1A 3294/4885
US-20120004315-A1 Selective Estrogen Receptor Modulator ESR1, GPER1, ESR2 MAOB 3399/4885ABCB1 1939/4885HTR1A 796/4885

“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.