SCHEMBL1102885

SCHEMBL1102885

c1ccc2c(-c3cnccn3)c3ncccc3c(-c3ncncn3)c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.35
HSP90AA1 P07900 2/20 0.35
NPC1 O15118 2/20 0.35
CYP2A6 P11509 2/20 0.35
CCR6 P51684 1/20 0.34
METAP2 P50579 1/20 0.33
PIM1 P11309 2/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK9 P45984 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30

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
SCHEMBL1102966 0.85 HSP90AA1 (0.44) L3MBTL1HSP90AA1NPC1METAP2KDM4E
SCHEMBL1102614 0.82 METAP2 (0.34) L3MBTL1CYP2A6METAP2PIM1KDM4E
SCHEMBL1103303 0.77 METAP2 (0.36) METAP2PIM1KDM4ECYP3A4MAPK9
SCHEMBL1102918 0.74 HSP90AA1 (0.45) L3MBTL1HSP90AA1NPC1METAP2KDM4E
SCHEMBL1102911 0.73 HSP90AA1 (0.42) L3MBTL1HSP90AA1NPC1METAP2KDM4E
SCHEMBL1102511 0.73 MAOA (0.40) NPC1PIM1KDM4ECYP3A4SMN1; SMN2
SCHEMBL1102737 0.72 KDM4E (0.52) L3MBTL1HSP90AA1NPC1CYP2A6KDM4E
SCHEMBL21560825 0.71 PIM1 (0.46) L3MBTL1HSP90AA1CYP2A6METAP2PIM1
SCHEMBL21560905 0.71 PIM1 (0.46) L3MBTL1HSP90AA1CYP2A6METAP2PIM1
SCHEMBL21560750 0.71 PIM1 (0.46) L3MBTL1HSP90AA1CYP2A6METAP2PIM1

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-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 L3MBTL1 1629/4885HSP90AA1 4884/4885NPC1 1582/4885

“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.