SCHEMBL21853575

SCHEMBL21853575

Cc1cc(C(C)(CC(C)(c2ccc(O)cc2)c2ccc(O)cc2)c2ccc(O)c(C)c2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.61
ESR2 Q92731 9/20 0.61
AR P10275 4/20 0.53
SHBG P04278 1/20 0.46
CYP3A4 P08684 2/20 0.43
LMNA P02545 1/20 0.43
TYR P14679 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR6 P50406 1/20 0.43
ESRRG P62508 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL673342 0.92 ESR1 (0.65) ESR1ESR2ARHPGDHSD17B10
SCHEMBL11721914 0.91 ESR1 (0.56) ESR1ESR2ARSHBGCYP3A4
SCHEMBL7969173 0.89 ESR1 (0.61) ESR1ESR2ARCYP3A4ALDH1A1
SCHEMBL10909749 0.87 ESR1 (0.69) ESR1ESR2AR
SCHEMBL14760222 0.87 ESR1 (0.69) ESR1ESR2AR
SCHEMBL30374804 0.86 ESR1 (0.54) ESR1ESR2AR
SCHEMBL2413116 0.86 ESR1 (0.57) ESR1ESR2ARSHBGCYP3A4
SCHEMBL30375402 0.84 ESR1 (0.56) ESR1ESR2ARCYP3A4ESRRG
SCHEMBL29499835 0.84 ESR1 (0.56) ESR1ESR2AR
SCHEMBL3967698 0.84 SHBG (0.60) ESR1ESR2ARSHBGCYP3A4

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-11530293-B2 Polyamides and amidoamines derived from hydroxyalkylpolyamines: epoxy curing agents with improved properties EVONIK OPERATIONS GMBH (DE) 2022-12-20 US disclosed
US-20200308339-A2 POLYAMIDES AND AMIDOAMINES DERIVED FROM HYROXYALKYLPOLYAMINES: EPOXY CURING AGENTS WITH IMPROVED PROPERTIES EVONIK OPERATIONS GMBH (DE) 2020-10-01 US disclosed
US-20200123312-A1 POLYAMIDES AND AMIDOAMINES DERIVED FROM HYROXYALKYLPOLYAMINES: EPOXY CURING AGENTS WITH IMPROVED PROPERTIES EVONIK OPERATIONS GMBH (DE) 2020-04-23 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 (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-20200123312-A1 POLYAMIDES AND AMIDOAMINES DERIVED FROM HYROXYALKYLPOLYAMINES: EPOXY CURING AGENTS WITH IMPROVED PROPERTIES PAM, HNMT, NAAA ESR1 1003/4885ESR2 1119/4885AR 1957/4885
US-11530293-B2 Polyamides and amidoamines derived from hydroxyalkylpolyamines: epoxy curing agents with improved properties NAAA, PAM, PARG ESR1 1534/4885ESR2 1591/4885AR 1962/4885
US-20200308339-A2 POLYAMIDES AND AMIDOAMINES DERIVED FROM HYROXYALKYLPOLYAMINES: EPOXY CURING AGENTS WITH IMPROVED PROPERTIES PAM, HNMT, NAAA ESR1 1003/4885ESR2 1119/4885AR 1957/4885

“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.