SCHEMBL228663

SCHEMBL228663

CCN(Cc1ccc(CCNC2CCCCC2)cc1)c1cc(OC)ccc1[C@@H]1CCc2cc(O)ccc2C1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.81
ESR2 Q92731 1/20 0.81
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
GRIN2B Q13224 7/20 0.41
GRIN1 Q05586 2/20 0.41
CYP26A1 O43174 1/20 0.40
DRD2 P14416 5/20 0.38
DRD3 P35462 5/20 0.38
DRD4 P21917 1/20 0.37
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35

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
SCHEMBL3996722 1.00 ESR1 (0.81) ESR1ESR2POLBKMT2AGRIN2B
SCHEMBL229237 0.92 ESR1 (0.71) ESR1ESR2KMT2AGRIN2BGRIN1
SCHEMBL229089 0.90 ESR1 (0.83) ESR1ESR2POLBKMT2AGRIN2B
SCHEMBL229090 0.90 ESR1 (0.83) ESR1ESR2POLBKMT2AGRIN2B
SCHEMBL229306 0.90 ESR1 (0.86) ESR1ESR2POLBKMT2AGRIN2B
SCHEMBL229305 0.90 ESR1 (0.86) ESR1ESR2POLBKMT2AGRIN2B
Elacestrant SCHEMBL229431 0.90 ESR1 (1.00) ESR1ESR2POLBKMT2AGRIN2B
Elacestrant SCHEMBL229432 0.90 ESR1 (1.00) ESR1ESR2POLBKMT2AGRIN2B
Elacestrant SCHEMBL29359701 0.90 ESR1 (1.00) ESR1ESR2POLBKMT2AGRIN2B
Elacestrant SCHEMBL2636500 0.89 ESR1 (0.98) ESR1ESR2POLBKMT2AGRIN2B

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8933130-B2 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. (US) 2015-01-13 US claimed
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP claimed
EP-2037905-B1 TREATMENT OF VASOMOTOR SYMPTOMS WITH SELECTIVE ESTROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2013-05-01 EP claimed
US-20100105733-A1 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. 2010-04-29 US claimed
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 claimed
US-8933130-B2 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. (US) 2015-01-13 US disclosed
US-8933130-B2 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. (US) 2015-01-13 US disclosed
US-8933130-B2 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. (US) 2015-01-13 US disclosed
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
EP-2037905-B1 TREATMENT OF VASOMOTOR SYMPTOMS WITH SELECTIVE ESTROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2013-05-01 EP disclosed
EP-2037905-B1 TREATMENT OF VASOMOTOR SYMPTOMS WITH SELECTIVE ESTROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2013-05-01 EP disclosed
US-20100105733-A1 Treatment of vasomotor symptoms with selective estrogen receptor modulators RADIUS HEALTH, INC. 2010-04-29 US disclosed
US-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR RADIUS HEALTH, INC. 2009-12-31 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-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
WO-2008002490-A2 TREATMENT OF VASOMOTOR SYMPTOMS WITH SELECTIVE ESTROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2008-01-03 WO 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 ESR1 1/4885ESR2 3/4885POLB 3238/4885
US-20100105733-A1 Treatment of vasomotor symptoms with selective estrogen receptor modulators GPER1, ESR1, SHBG ESR1 2/4885ESR2 4/4885POLB 4777/4885
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 ESR1 34/4885ESR2 21/4885POLB 2092/4885

“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.