SCHEMBL25818506

SCHEMBL25818506

Clc1nc(-c2cccc(-c3ccc4c(-c5ccccc5)cc(-c5ccccc5)cc4c3)c2)nc(-c2ccc3sc4ccc(-c5ccccc5)cc4c3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 2/20 0.39
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
F9 P00740 3/20 0.34
LIMK1 P53667 1/20 0.34
ROCK1 Q13464 1/20 0.33
PIK3CA P42336 1/20 0.32
PI4KA P42356 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAP3K8 P41279 1/20 0.31
MAP4K4 O95819 1/20 0.30

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
SCHEMBL25818416 0.98 PIM3 (0.37) PIM3HSD17B1HSD17B2F9LIMK1
SCHEMBL25817707 0.91 PIM3 (0.40) PIM3HSD17B1HSD17B2F9LIMK1
SCHEMBL25818386 0.89 F9 (0.38) PIM3HSD17B1HSD17B2F9MEN1
SCHEMBL26363520 0.88 PIM3 (0.40) PIM3LIMK1ROCK1PIK3CAPI4KA
SCHEMBL22161555 0.87 PIM3 (0.40) PIM3LIMK1ROCK1PIK3CAPI4KA
SCHEMBL25818528 0.86 PIM3 (0.38) PIM3F9LIMK1ROCK1PIK3CA
SCHEMBL23437787 0.85 GPR3 (0.38) PIM3LIMK1ROCK1MEN1ALDH1A1
SCHEMBL22076582 0.85 GPR3 (0.38) PIM3LIMK1ROCK1PIK3CAPI4KA
SCHEMBL25818483 0.85 KDM4E (0.34) PIM3HSD17B1HSD17B2F9PIM1
SCHEMBL25818447 0.84 F9 (0.38) PIM3F9LIMK1ROCK1ALDH1A1

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 PIM3 3432/4885HSD17B1 3460/4885HSD17B2 2761/4885
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF NFE2L2, ESR1, OR51E2 PIM3 3432/4885HSD17B1 3460/4885HSD17B2 2761/4885

“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.