SCHEMBL25730880

SCHEMBL25730880

c1ccc2cc(-c3ccc(N(c4ccc(-c5cccc6c5ccc5ccccc56)cc4)c4ccc5ccc6ccccc6c5c4)cc3)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CA12 O43570 2/20 0.41
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
HPRT1 P00492 3/20 0.39
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
CYP1B1 Q16678 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PIM1 P11309 2/20 0.36
MCL1 Q07820 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
GSTP1 P09211 1/20 0.36
CYP1A1 P04798 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35

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
SCHEMBL25730786 0.96 CA12 (0.45) CA1CA2CA9CA12ESR1
SCHEMBL25088236 0.94 CA12 (0.41) CA1CA2CA9CA12ESR1
SCHEMBL24029674 0.94 CA12 (0.44) CA1CA2CA9CA12ESR1
SCHEMBL25088893 0.94 CA12 (0.43) CA1CA2CA9CA12ESR1
SCHEMBL25088245 0.94 CA12 (0.46) CA1CA2CA9CA12ESR1
SCHEMBL25088235 0.93 CA12 (0.43) CA1CA2CA9CA12ESR1
SCHEMBL25088782 0.93 CA12 (0.43) CA1CA2CA9CA12ESR1
SCHEMBL25730819 0.93 CA12 (0.45) CA1CA2CA9CA12ESR1
SCHEMBL26063350 0.93 CA12 (0.42) CA1CA2CA9CA12ESR1
SCHEMBL26045972 0.93 HPRT1 (0.40) CA1CA2CA9CA12HPRT1

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 CA1 2048/4885CA2 2612/4885CA9 2772/4885

“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.