SCHEMBL20801563

SCHEMBL20801563

CC(=O)C1CCC(CC(C)(C)C)CC1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.60
THRB P10828 1/20 0.60
PLG P00747 1/20 0.35
PLAT P00750 1/20 0.35
LMNA P02545 1/20 0.35
LIPA P38571 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
POLB P06746 2/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
PKM P14618 1/20 0.30

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
SCHEMBL9917284 0.82 THRA (0.60) THRATHRBPLGPLATLMNA
SCHEMBL15706268 0.80 THRA (0.58) THRATHRBPLGPLATLMNA
SCHEMBL22472706 0.80 THRA (0.58) THRATHRBPLGPLATLMNA
SCHEMBL13235869 0.77 CYP2C9 (0.42) THRATHRBPLGPLATLMNA
SCHEMBL76462 0.77
SCHEMBL2617044 0.77 MAPT (0.38) PLGPLATLMNAPOLBHPGD
SCHEMBL13165512 0.77 MAPT (0.38) PLGPLATLMNAPOLBHPGD
SCHEMBL13165462 0.77 MAPT (0.38) PLGPLATLMNAPOLBHPGD
SCHEMBL7155825 0.77
SCHEMBL12363910 0.77 THRA (0.55) THRATHRBPLGPLATLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133772-A1 NOVEL ISOMERIC COMPOUNDS COMPRISING A RING-OPENED THIOSUCCINIMIDE GROUP, AN OLIGOPEPTIDE FRAGMENT AND A CHIRAL MOIETY GENEQUANTUM HEALTHCARE (SUZHOU) CO., LTD. (CN) 2022-06-30 WO disclosed
US-10787480-B2 Cytotoxic peptides and conjugates thereof NOVARTIS AG (CH) 2020-09-29 US disclosed
US-10675358-B2 Antibody adjuvant conjugates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2020-06-09 US disclosed
US-20190076547-A1 ANTIBODY ADJUVANT CONJUGATES BOLT BIOTHERAPEUTICS, INC. 2019-03-14 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-10787480-B2 Cytotoxic peptides and conjugates thereof CD47, NGLY1, VIP THRA 3963/4885THRB 3616/4885PLG 3139/4885
US-10675358-B2 Antibody adjuvant conjugates FCGR1A, FCGR3B, FCGR2A THRA 3400/4885THRB 4014/4885PLG 4408/4885
US-20190076547-A1 ANTIBODY ADJUVANT CONJUGATES FCGR1A, FCGR3B, FCGR2A THRA 3241/4885THRB 3935/4885PLG 4420/4885

“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.