SCHEMBL17368355

SCHEMBL17368355

c1ccc(C2(c3ccccc3)c3ccccc3-c3c2cc2c4cc5[nH]c6ccccc6c5c5cccc(c6cccc3c62)c45)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.34
AHR P35869 2/20 0.33
MAP3K9 P80192 1/20 0.33
MAP3K11 Q16584 1/20 0.33
MEN1 O00255 3/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 3/20 0.33
IMPDH2 P12268 1/20 0.33
IMPDH1 P20839 1/20 0.33
CDK4 P11802 4/20 0.32
CCND1 P24385 4/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.32
TOP2A P11388 1/20 0.31
PRKD3 O94806 1/20 0.31
CCNB2 O95067 1/20 0.31
CCNE2 O96020 1/20 0.31
PRKCG P05129 1/20 0.31
PRKCB P05771 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
SCHEMBL17368356 0.91 PARP1 (0.36) PARP1AHRMAP3K9MAP3K11MEN1
SCHEMBL15940475 0.83 PARP1 (0.39) PARP1AHRMAP3K9MAP3K11MEN1
SCHEMBL17368231 0.77 KDM4E (0.31) MEN1MAPTKMT2AKDM4ELMNA
SCHEMBL17368239 0.76 KDM4E (0.31) MEN1MAPTKMT2AKDM4ELMNA
SCHEMBL23408735 0.76 ALDH1A1 (0.35) AHRMEN1MAPTKMT2AKDM4E
SCHEMBL3424030 0.76 PARP1 (0.48) PARP1AHRMAP3K9MAP3K11MEN1
SCHEMBL29520364 0.76 PARP1 (0.48) PARP1AHRMAP3K9MAP3K11MEN1
SCHEMBL18688071 0.73 PARP1 (0.40) PARP1MAP3K9MAP3K11MEN1MAPT
SCHEMBL19980374 0.72 KDM4E (0.41) PARP1AHRMAP3K9MAP3K11MEN1
SCHEMBL18688087 0.72 CDK4 (0.46) PARP1MAP3K9MAP3K11MEN1MAPT

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-9871207-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-01-16 US disclosed
US-9871207-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-01-16 US disclosed
US-20150380661-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-31 US disclosed
US-20150380661-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-31 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-20150380661-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF OR51E2, NFE2L2, ORAI2 PARP1 3049/4885AHR 1832/4885MAP3K9 3405/4885

“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.