SCHEMBL23472013

SCHEMBL23472013

c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6c(ccc7ccccc76)c5)cc4)c4cc5ccccc5c5ccccc45)cc3)cccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.43
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA9 Q16790 4/20 0.43
HPRT1 P00492 3/20 0.38
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP1B1 Q16678 1/20 0.36
MCL1 Q07820 1/20 0.35
ACMSD Q8TDX5 1/20 0.35
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
CHRNB4 P30926 1/20 0.34

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
SCHEMBL25088882 0.97 CA12 (0.42) CA12CA1CA2CA9HPRT1
SCHEMBL25088791 0.96 CA1 (0.39) CA12CA1CA2CA9HPRT1
SCHEMBL22669932 0.96 CA12 (0.42) CA12CA1CA2CA9HSD17B1
SCHEMBL25088247 0.96 CA1 (0.39) CA12CA1CA2CA9HPRT1
SCHEMBL21203605 0.96 CA12 (0.45) CA12CA1CA2CA9HSD17B1
SCHEMBL21203689 0.95 CA12 (0.44) CA12CA1CA2CA9HSD17B1
SCHEMBL25088794 0.95 CA12 (0.44) CA12CA1CA2CA9HPRT1
SCHEMBL22671838 0.95 CA12 (0.43) CA12CA1CA2CA9HPRT1
SCHEMBL22671882 0.95 CA12 (0.43) CA12CA1CA2CA9HPRT1
SCHEMBL12159641 0.94 CA12 (0.44) CA12CA1CA2CA9HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210359223-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2021-11-18 US disclosed
EP-3832745-A1 ORGANIC LIGHT-EMITTING ELEMENT LG Chem, Ltd. (KR) 2021-06-09 EP 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-20210359223-A1 ORGANIC LIGHT-EMITTING ELEMENT LAS1L, ARL1, NAP1L4 CA12 1397/4885CA1 1427/4885CA2 1807/4885

“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.