Sugi Predict

Sugi Predict / Compounds / SCHEMBL25817779

SCHEMBL25817779

SCHEMBL25817779

c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccc6c(-c7ccccc7)cccc6c5)c4)nc(-c4ccc5sc6ccccc6c5c4)n3)cc2-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 1/20 0.40
▸ HSD17B2 P37059 1/20 0.40
▸ F9 P00740 1/20 0.38
▸ PIM3 Q86V86 1/20 0.36
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ S1PR5 Q9H228 4/20 0.33
▸ S1PR4 O95977 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ SCN5A Q14524 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MPI P34949 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL25817698 0.92 S1PR5 (0.40) HSD17B1HSD17B2F9PIM3CA12
SCHEMBL25818386 0.90 F9 (0.38) HSD17B1HSD17B2F9PIM3CA12
SCHEMBL23027593 0.89 PIM3 (0.37) HSD17B1HSD17B2F9PIM3CA12
SCHEMBL26278731 0.89 S1PR5 (0.40) F9PIM3S1PR5S1PR4KDM4E
SCHEMBL25817707 0.87 PIM3 (0.40) HSD17B1HSD17B2F9PIM3KDM4E
SCHEMBL23027563 0.87 PIM3 (0.40) F9PIM3CA12CA1CA2
SCHEMBL25817821 0.87 PIM1 (0.36) HSD17B1HSD17B2F9PIM3CA12
SCHEMBL26278919 0.87 F9 (0.36) HSD17B1HSD17B2F9PIM3CA12
SCHEMBL29311116 0.87 PIM3 (0.39) HSD17B1HSD17B2F9PIM3KDM4E
SCHEMBL27390588 0.87 PIM3 (0.43) F9PIM3ALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11917914-B1 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2024-02-27 — — US disclosed
US-11917914-B1 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2024-02-27 — — US disclosed
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-07-13 — — US disclosed
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-07-13 — — 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 (2 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-11917914-B1 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof NFE2L2, ESR1, OR51E2 HSD17B1 3460/4885HSD17B2 2761/4885F9 1377/4885
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF NFE2L2, ESR1, OR51E2 HSD17B1 3460/4885HSD17B2 2761/4885F9 1377/4885

“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.