SCHEMBL20971990

SCHEMBL20971990

CC[C@H](C(=O)Cl)N(CC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.35
TSHR P16473 2/20 0.35
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
CYP2C19 P33261 1/20 0.34
FABP5 Q01469 3/20 0.33
KMT2A Q03164 2/20 0.33
FABP7 O15540 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
HTR2A P28223 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL20971992 1.00 CYP1A2 (0.35) CYP1A2TSHRPPARGPPARACYP2C19
SCHEMBL23525180 0.86 CYP1A2 (0.35) CYP1A2TSHRPPARGPPARAFABP5
SCHEMBL1198343 0.83 CYP1A2 (0.37) CYP1A2TSHRPPARGPPARAFABP5
SCHEMBL16933080 0.83 CYP1A2 (0.37) CYP1A2TSHRPPARGPPARAFABP5
SCHEMBL17505605 0.81 HTR2A (0.37) CYP1A2TSHRPPARGPPARAFABP5
SCHEMBL17505607 0.81 HTR2A (0.37) CYP1A2TSHRPPARGPPARAFABP5
SCHEMBL22804049 0.78 CYP1A2 (0.41) CYP1A2TSHRPPARGPPARA
SCHEMBL23525418 0.77 BCHE (0.34) CYP1A2TSHRPPARGPPARAPOLB
SCHEMBL22344856 0.76 KMT2A (0.44) CYP1A2CYP2C19KMT2A
SCHEMBL22344859 0.76 KMT2A (0.44) CYP1A2CYP2C19KMT2A

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
US-20210330651-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC 2021-10-28 US disclosed
US-11065234-B2 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2021-07-20 US disclosed
US-11065233-B2 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2021-07-20 US disclosed
US-10959989-B2 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2021-03-30 US disclosed
US-20200261428-A1 ESTROGEN RECEPTOR MODULATORS KALYRA PHARMACEUTICALS, INC. 2020-08-20 US disclosed
US-20200261430-A1 ESTROGEN RECEPTOR MODULATORS KALYRA PHARMACEUTICALS, INC. 2020-08-20 US disclosed
US-20200261429-A1 ESTROGEN RECEPTOR MODULATORS KALYRA PHARMACEUTICALS, INC. 2020-08-20 US disclosed
US-20190142811-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC 2019-05-16 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 (8 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-11065233-B2 Estrogen receptor modulators ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-20200261430-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-20200261428-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-20190142811-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-20200261429-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-10959989-B2 Estrogen receptor modulators ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-20210330651-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885
US-11065234-B2 Estrogen receptor modulators ESR2, GPER1, ESRRG CYP1A2 292/4885TSHR 125/4885PPARG 101/4885

“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.