SCHEMBL19744179

SCHEMBL19744179

COC(CNCCCN)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.46
CA6 P23280 5/20 0.46
CA7 P43166 5/20 0.46
CA9 Q16790 5/20 0.46
CA14 Q9ULX7 5/20 0.46
CA5B Q9Y2D0 5/20 0.46
CA2 P00918 4/20 0.46
CA4 P22748 4/20 0.46
CA5A P35218 4/20 0.46
ALOX15 P16050 3/20 0.46
CASP2 P42575 2/20 0.46
F13A1 P00488 2/20 0.46
CYP1A2 P05177 2/20 0.46
THPO P40225 2/20 0.46
MEN1 O00255 2/20 0.46
RECQL P46063 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ESR1 P03372 1/20 0.44

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
SCHEMBL19744358 0.93 CA12 (0.48) CA12CA6CA7CA9CA14
SCHEMBL19743810 0.91 CA12 (0.46) CA12CA6CA7CA9CA14
SCHEMBL21244314 0.91 CA12 (0.46) CA12CA6CA7CA9CA14
SCHEMBL21244317 0.91 CA12 (0.43) CA12CA6CA7CA9CA14
SCHEMBL6055711 0.79 TSHR (0.46) CA12CA7CA14CA2MEN1
SCHEMBL6525329 0.77 ALDH1A1 (0.39) CYP1A2MEN1RECQLKMT2ACYP2C19
SCHEMBL6523132 0.76
SCHEMBL1668578 0.76 TSHR (0.50) TSHRANPEPALDH1A1
SCHEMBL987948 0.76 TSHR (0.50) TSHRANPEPALDH1A1
SCHEMBL1532449 0.76 TSHR (0.50) TSHRANPEPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3475257-B1 ACETALANTHRAQUINONE DERIVATIVES USEFUL FOR CELLULAR STAINING BIOSTATUS LTD (GB) 2023-06-07 EP disclosed
US-11447638-B2 Acetalanthraquinone derivatives useful for cellular staining BIOSTATUS LIMITED (GB) 2022-09-20 US disclosed
US-20190249011-A1 ACETALANTHRAQUINONE DERIVATIVES USEFUL FOR CELLULAR STAINING BIOSTATUS LIMITED (GB) 2019-08-15 US disclosed
EP-3475257-A1 ACETALANTHRAQUINONE DERIVATIVES USEFUL FOR CELLULAR STAINING Biostatus Limited (GB) 2019-05-01 EP disclosed
WO-2017220969-A1 ACETALANTHRAQUINONE DERIVATIVES USEFUL FOR CELLULAR STAINING BIOSTATUS LIMITED (GB) 2017-12-28 WO 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-11447638-B2 Acetalanthraquinone derivatives useful for cellular staining ERH, NR2E3, NR0B2 CA12 1060/4885CA6 1781/4885CA7 2035/4885

“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.