SCHEMBL19997880

SCHEMBL19997880

c1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)nc4c3sc3ccccc34)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 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
SCHEMBL19247115 0.93 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL19997877 0.92 KDM4E (0.33) LIMK1KDM4EATML3MBTL1PIM1
SCHEMBL19246819 0.90 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL18961904 0.88 LIMK1 (0.33) LIMK1PIM1PIM2
SCHEMBL20226371 0.88 LIMK1 (0.33) LIMK1PIM1PIM2
SCHEMBL26742879 0.86 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL18962001 0.86 PIM1 (0.35) LIMK1PIM1PIM2
SCHEMBL17297625 0.86 PIM1 (0.32) LIMK1PIM1PIM2
SCHEMBL19247759 0.85 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL19248052 0.85 KDM4E (0.33) KDM4EATML3MBTL1

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-20180090689-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-29 US disclosed
US-20180090689-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-29 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-20180090689-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE OXER1, OCIAD1, OR10J3 LIMK1 153/4885KDM4E 3867/4885ATM 3788/4885

“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.