SCHEMBL21288046

SCHEMBL21288046

CC(C)(C)C(=O)CN(CC(=O)C(C)(C)C)C(Cc1ccc(-c2ccc(O)cc2)cc1)C(=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.38
▸ ESR2 Q92731 4/20 0.38
▸ SLC7A5 Q01650 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ TAAR1 Q96RJ0 3/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ BLM P54132 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MIF P14174 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ MME P08473 1/20 0.33
▸ ACE P12821 1/20 0.33
▸ ACE2 Q9BYF1 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
SCHEMBL19929952 0.85 ACACB (0.40) MAPTALDH1A1
SCHEMBL19929953 0.80 ACACB (0.43) —
SCHEMBL21288164 0.80 CA2 (0.32) —
SCHEMBL1706858 0.76 ESR1 (0.42) ESR1ESR2SLC7A5TAAR1SLC6A2
SCHEMBL21288120 0.74 ACACB (0.41) —
SCHEMBL14200040 0.70 TAAR1 (0.45) ESR1ESR2SLC7A5MAPK1TAAR1
SCHEMBL26897330 0.69 ALDH1A1 (0.51) TAAR1MAPTALDH1A1GAAMME
SCHEMBL24238523 0.69 KMT2A (0.33) ESR1ESR2
SCHEMBL1704939 0.68 ESR1 (0.46) ESR1ESR2SLC7A5TAAR1SLC6A2
SCHEMBL16501755 0.68 SLC7A5 (0.62) ESR1ESR2SLC7A5TAAR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190256849-A1 Targeting Ligands SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT 2019-08-22 — — 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 (1 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-20190256849-A1 Targeting Ligands FABP1, SNRPE, HAVCR2 ESR1 3204/4885ESR2 1367/4885SLC7A5 3028/4885

“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.

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