SCHEMBL787351

SCHEMBL787351

c1ccc2oc(-c3ccc(-c4ccc(-c5nc6ccccc6s5)nc4)cn3)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.50
RAB9A P51151 11/20 0.50
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 6/20 0.49
TP53 P04637 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HSD17B10 Q99714 4/20 0.49
HPGD P15428 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 4/20 0.48
GAA P10253 3/20 0.48
LMNA P02545 2/20 0.48
NFKB1 P19838 1/20 0.48
STAT1 P42224 1/20 0.48
GFER P55789 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
SCHEMBL14939052 0.86 NPC1 (0.64) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL787048 0.86 RAB9A (0.64) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL23639444 0.85 NPC1 (0.45) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL26023364 0.82 NPC1 (0.58) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL7208787 0.81 RAB9A (0.71) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL8991921 0.81 RAB9A (0.53) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL2176921 0.77 RAB9A (0.59) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL23079676 0.77 NPC1 (0.56) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL24332552 0.77 NPC1 (0.55) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL23080024 0.77 NPC1 (0.52) NPC1RAB9AMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9859517-B2 White organic light-emitting diode NITTO DENKO CORPORATION (JP) 2018-01-02 US disclosed
EP-2616457-B1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORP (JP) 2016-06-22 EP disclosed
EP-2616457-B1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORP (JP) 2016-06-22 EP disclosed
US-9328086-B2 Substituted bipyridines for use in organic light-emitting devices NITTO DENKO CORPORATION (JP) 2016-05-03 US disclosed
US-9328086-B2 Substituted bipyridines for use in organic light-emitting devices NITTO DENKO CORPORATION (JP) 2016-05-03 US disclosed
US-9328086-B2 Substituted bipyridines for use in organic light-emitting devices NITTO DENKO CORPORATION (JP) 2016-05-03 US disclosed
US-9328086-B2 Substituted bipyridines for use in organic light-emitting devices NITTO DENKO CORPORATION (JP) 2016-05-03 US disclosed
US-20140070194-A1 WHITE ORGANIC LIGHT-EMITTING DIODE NITTO DENKO CORPORATION (JP) 2014-03-13 US disclosed
US-20140070194-A1 WHITE ORGANIC LIGHT-EMITTING DIODE NITTO DENKO CORPORATION (JP) 2014-03-13 US disclosed
JP-2013541526-A 2013-11-14 JP disclosed
EP-2616457-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES Nitto Denko Corporation (JP) 2013-07-24 EP disclosed
EP-2616457-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES Nitto Denko Corporation (JP) 2013-07-24 EP disclosed
CN-103209975-A Substituted bipyridines for use in organic light-emitting devices NITTO DENKO CORP 2013-07-17 CN disclosed
US-20120179089-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-07-12 US disclosed
US-20120179089-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-07-12 US disclosed
US-20120179089-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-07-12 US disclosed
US-20120179089-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-07-12 US disclosed
WO-2012037269-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-03-22 WO disclosed
WO-2012037269-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-03-22 WO disclosed
WO-2012037269-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-03-22 WO 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-20120179089-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES BRD9, PIR, BRD2 NPC1 4104/4885RAB9A 3592/4885MEN1 4250/4885

“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.