SCHEMBL20108877

SCHEMBL20108877

O=P(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)c1ccc2ccc3ccc(-c4ccccc4)nc3c2n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.43
CYP1A1 P04798 1/20 0.37
CYP1B1 Q16678 1/20 0.37
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
NQO2 P16083 1/20 0.34
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
UTRN P46939 4/20 0.33
CYP2C9 P11712 1/20 0.33
MAPT P10636 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CTRC Q99895 1/20 0.32

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
SCHEMBL20108851 0.87 PARP1 (0.44) PARP1PIM1PIM2MEN1RAB9A
SCHEMBL20108882 0.82 PARP1 (0.40) PARP1CYP1A1CYP1B1PIM1PIM2
SCHEMBL20108909 0.80 RAB9A (0.45) PARP1PIM1PIM2MEN1RAB9A
SCHEMBL20108846 0.80 CYP1A1 (0.45) PARP1CYP1A1CYP1B1RAB9ACYP2C9
SCHEMBL20108834 0.80 LMNA (0.47) MEN1RAB9AKMT2AMAPT
SCHEMBL17451965 0.79 TOP1 (0.42) PARP1PIM1PIM2MEN1KMT2A
SCHEMBL17451937 0.78 TOP1 (0.38) PARP1CYP1A1CYP1B1UTRNCYP2C9
SCHEMBL19009622 0.78 TDP1 (0.42) PARP1MEN1KMT2AMAPTCYP17A1
SCHEMBL20108898 0.77 NOS1 (0.39) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL17403775 0.77 PARP1 (0.46) PARP1PIM1PIM2MEN1RAB9A

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 PARP1 2652/4885CYP1A1 984/4885CYP1B1 1088/4885
US-11155543-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD2, OCIAD1, PPOX PARP1 2652/4885CYP1A1 984/4885CYP1B1 1088/4885

“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.