SCHEMBL25730832

SCHEMBL25730832

c1ccc2c(-c3ccc(N(c4ccc5ccc6ccccc6c5c4)c4cccc5c4sc4ccccc45)cc3)cccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
F9 P00740 1/20 0.36
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
PRKDC P78527 2/20 0.32
PARP14 Q460N5 1/20 0.32
S1PR5 Q9H228 3/20 0.32
S1PR4 O95977 2/20 0.32
ENPP3 O14638 1/20 0.32
ENPP1 P22413 1/20 0.32
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL26046003 0.98 ALOX5 (0.40) ALOX5F9CA12CA1CA2
SCHEMBL25731103 0.97 ALOX5 (0.41) ALOX5F9CA12CA1CA2
SCHEMBL25731176 0.95 ALOX5 (0.47) ALOX5F9CA12CA1CA2
SCHEMBL21123699 0.93 F9 (0.39) ALOX5F9CA12CA1CA2
SCHEMBL26057261 0.93 ALOX5 (0.40) ALOX5F9CA12CA1CA2
SCHEMBL24029595 0.93 ALOX5 (0.41) ALOX5F9CA12CA1CA2
SCHEMBL26056809 0.92 ALOX5 (0.39) ALOX5F9CA12CA1CA2
SCHEMBL26063618 0.92 ALOX5 (0.39) ALOX5F9CA12CA1CA2
SCHEMBL25731185 0.92 ALOX5 (0.44) ALOX5F9MCL1ACMSDPRKDC
SCHEMBL25730988 0.92 ALOX5 (0.38) ALOX5F9ALDH1A1HIF1ACYP1B1

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 ALOX5 359/4885F9 1393/4885CA12 1997/4885

“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.