SCHEMBL25730819

SCHEMBL25730819

c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6c(ccc7ccccc76)c5)cc4)c4ccc5ccc6ccccc6c5c4)cc3)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.45
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA9 Q16790 4/20 0.45
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 3/20 0.42
HIF1A Q16665 2/20 0.42
CYP1B1 Q16678 1/20 0.42
MCL1 Q07820 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
HSD17B1 P14061 2/20 0.38
HSD17B2 P37059 2/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CYP1A2 P05177 2/20 0.37
HPGD P15428 2/20 0.37
ENPP3 O14638 1/20 0.37
ENPP1 P22413 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36

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
SCHEMBL24154556 0.97 CA12 (0.43) CA12CA1CA2CA9ALDH1A1
SCHEMBL24029413 0.96 CA12 (0.44) CA12CA1CA2CA9ALDH1A1
SCHEMBL23471669 0.96 CA12 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL25730786 0.94 CA12 (0.45) CA12CA1CA2CA9ALDH1A1
SCHEMBL25088238 0.94 CA12 (0.47) CA12CA1CA2CA9ALDH1A1
SCHEMBL25730815 0.94 ALDH1A1 (0.44) CA12CA1CA2CA9ALDH1A1
SCHEMBL25730818 0.94 CA12 (0.47) CA12CA1CA2CA9ALDH1A1
SCHEMBL25731751 0.94 CA12 (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL24029414 0.93 CA12 (0.44) CA12CA1CA2CA9ALDH1A1
SCHEMBL25730880 0.93 CA1 (0.41) CA12CA1CA2CA9ALDH1A1

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-20230200220-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
US-20230200220-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 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-20230200220-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME MAOA, NFE2L2, SLC1A2 CA12 1997/4885CA1 2048/4885CA2 2612/4885

“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.