SCHEMBL20009966

SCHEMBL20009966

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4[nH]c5ccc(-c6ccc(-c7ccccn7)cn6)cc5c4c3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 5/20 0.46
CHEK1 O14757 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP2A6 P11509 1/20 0.40
AXL P30530 1/20 0.40
PIM1 P11309 2/20 0.39
PIM2 Q9P1W9 1/20 0.39
CHEK2 O96017 1/20 0.39
DHODH Q02127 1/20 0.39
NPY5R Q15761 1/20 0.39
PRMT5 O14744 2/20 0.39
WDR77 Q9BQA1 1/20 0.39
AURKA O14965 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38

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
SCHEMBL20009981 0.99 HPGDS (0.45) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL23712243 0.93 HPGDS (0.49) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20010293 0.91 HPGDS (0.48) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20010077 0.86 MKNK1 (0.45) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20009965 0.86 TLR8 (0.45) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20010279 0.86 MKNK1 (0.45) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20010021 0.86 DHODH (0.44) HPGDSNPC1RAB9ASMN1; SMN2CYP2A6
SCHEMBL20009871 0.85 TLR8 (0.47) HPGDSCHEK1CYP2A6PIM1PIM2
SCHEMBL20009907 0.85 TLR8 (0.44) HPGDSCHEK1NPC1RAB9ASMN1; SMN2
SCHEMBL20010115 0.85 CYP2A6 (0.47) HPGDSNPC1RAB9ASMN1; SMN2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210320261-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2021-10-14 US disclosed
US-11081648-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2021-08-03 US disclosed
US-10468605-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2019-11-05 US disclosed
US-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-03-29 US disclosed
US-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY 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 (4 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-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 HPGDS 4477/4885CHEK1 4021/4885NPC1 1125/4885
US-20210320261-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 HPGDS 4354/4885CHEK1 3716/4885NPC1 1283/4885
US-10468605-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 HPGDS 4477/4885CHEK1 4021/4885NPC1 1125/4885
US-11081648-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 HPGDS 4477/4885CHEK1 4021/4885NPC1 1125/4885

“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.