Sugi Predict

Sugi Predict / Compounds / SCHEMBL20108862

SCHEMBL20108862

SCHEMBL20108862

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3c(-c4ccccc4)c4cc(-c5ccc6ccc7ccc(-c8ccccc8)nc7c6n5)ccc4c(-c4ccccc4)c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 1/20 0.39
▸ PARP1 P09874 1/20 0.36
▸ ESR1 P03372 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ NQO2 P16083 1/20 0.33
▸ ALK Q9UM73 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ PLG P00747 1/20 0.32
▸ PLAU P00749 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ HSD17B1 P14061 1/20 0.32
▸ CYP2B6 P20813 1/20 0.32
▸ HSD17B2 P37059 1/20 0.32
▸ CYP1A1 P04798 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
SCHEMBL20108843 0.91 TOP1 (0.38) TOP1PARP1PLGPLAUCYP3A4
SCHEMBL20108835 0.91 TOP1 (0.38) TOP1PARP1PLGPLAUCYP3A4
SCHEMBL20108913 0.90 TOP1 (0.35) TOP1PRMT5PLGPLAUDHODH
SCHEMBL20250444 0.89 ESR1 (0.41) PARP1ESR1ESR2ALKPLG
SCHEMBL20108845 0.88 TOP1 (0.37) TOP1PARP1CYP3A4CYP2D6PIM1
SCHEMBL20250422 0.87 ESR1 (0.41) PARP1ESR1ESR2ALKDHODH
SCHEMBL10353755 0.87 ESR1 (0.41) PARP1ESR1ESR2ALKDHODH
SCHEMBL21103665 0.85 PARP1 (0.40) PARP1ESR1ESR2ALKDHODH
SCHEMBL17174127 0.85 PARP1 (0.46) TOP1PARP1CYP1A1CYP1B1PIM1
SCHEMBL17174105 0.85 PARP1 (0.46) TOP1PARP1CYP1A1CYP1B1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11155543-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2021-10-26 — — US disclosed
US-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-03 — — US disclosed
US-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-03 — — 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-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD2, OCIAD1, PPOX TOP1 2172/4885PARP1 2652/4885ESR1 107/4885
US-11155543-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD2, OCIAD1, PPOX TOP1 2172/4885PARP1 2652/4885ESR1 107/4885

“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.