SCHEMBL20108871

SCHEMBL20108871

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3ccc4ccc(-c5ccccc5)nc4c3n2)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 0.41
PARP1 P09874 1/20 0.39
AR P10275 4/20 0.35
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RAB9A P51151 1/20 0.33
CYP2C9 P11712 2/20 0.32
KCNA5 P22460 1/20 0.32
CYP3A4 P08684 1/20 0.32
TACR3 P29371 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
SCHEMBL20108875 0.99 TOP1 (0.41) TOP1PARP1ARPIM1PIM2
SCHEMBL20108876 0.93 TOP1 (0.46) TOP1PARP1ARPIM1PIM2
SCHEMBL20108861 0.90 TOP1 (0.41) TOP1PARP1PIM1PIM2MEN1
SCHEMBL20108840 0.87 LMNA (0.41) TOP1ARMEN1KMT2ACYP2C9
SCHEMBL20108850 0.86 LMNA (0.40) TOP1ARMEN1KMT2ACYP2C9
SCHEMBL20108866 0.85 TOP1 (0.42) TOP1PARP1CYP2C9CYP3A4
SCHEMBL20108899 0.85 CYP2C9 (0.40) TOP1MEN1KMT2ARAB9ACYP2C9
SCHEMBL20108912 0.84 CYP2C9 (0.39) TOP1MEN1KMT2ARAB9ACYP2C9
SCHEMBL20108904 0.83 TOP1 (0.41) TOP1MEN1KMT2ARAB9ACYP2C9
SCHEMBL10032332 0.82 PARP1 (0.47) PARP1ARPIM1PIM2MEN1

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 2652/4885AR 3068/4885
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 2652/4885AR 3068/4885

“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.