SCHEMBL1102963

SCHEMBL1102963

c1ccc2oc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6nc7ccccc7o6)cc5)c5ncccc45)cc3)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.52
RAB9A P51151 9/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ATM Q13315 1/20 0.52
ALDH1A1 P00352 7/20 0.50
HPGD P15428 6/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
HSD17B10 Q99714 5/20 0.50
KDM4E B2RXH2 5/20 0.50
TP53 P04637 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2C9 P11712 1/20 0.50
MAPT P10636 2/20 0.48
HCRTR1 O43613 1/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP3 P42574 1/20 0.48

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
SCHEMBL27365149 0.87 NPC1 (0.67) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620994 0.86 NPC1 (0.50) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620998 0.86 NPC1 (0.59) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620993 0.85 NPC1 (0.68) NPC1RAB9AMEN1KMT2AATM
SCHEMBL1925604 0.84 NPC1 (0.63) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621006 0.83 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621007 0.83 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621010 0.83 NPC1 (0.54) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621002 0.83 NPC1 (0.58) NPC1RAB9AMEN1KMT2AATM
SCHEMBL4360878 0.83 NPC1 (0.61) NPC1RAB9AMEN1KMT2AATM

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-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
EP-2147962-A1 Azaanthracene-derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-27 EP 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 NPC1 1582/4885RAB9A 3169/4885MEN1 4462/4885

“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.