SCHEMBL19997882

SCHEMBL19997882

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5c6c7ccccc7n(-c7ccccc7)c6ccc54)nc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTR1A P08908 4/20 0.31
HTR7 P34969 4/20 0.31
PDE1B Q01064 1/20 0.31
PDE3A Q14432 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
HRH4 Q9H3N8 1/20 0.30
LIMK1 P53667 2/20 0.30
KMT2A Q03164 1/20 0.30
IL1R1 P14778 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
SCHEMBL18124862 0.98 TNKS (0.33) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL19247028 0.98 L3MBTL1 (0.37) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL18124886 0.94 LIMK1 (0.32) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL22708526 0.92 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL23874729 0.92 L3MBTL1 (0.33) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL20226367 0.92 TNKS (0.33) TNKSTNKS2HRH4LIMK1
SCHEMBL18961918 0.91 TNKS (0.32) TNKSTNKS2LIMK1
SCHEMBL22708527 0.90 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL17087600 0.89 KDM4E (0.38) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL20670239 0.89 MEN1 (0.34) L3MBTL1TNKSTNKS2LMNAMAPT

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 KDM4E 3867/4885ATM 3788/4885L3MBTL1 4497/4885

“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.