SCHEMBL805832

SCHEMBL805832

Brc1ccc(-c2nc3ccccc3o2)nc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.60
HSD17B10 Q99714 8/20 0.60
ALDH1A1 P00352 6/20 0.60
RAB9A P51151 6/20 0.60
TP53 P04637 6/20 0.60
HPGD P15428 5/20 0.60
KDM4E B2RXH2 5/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
PKM P14618 3/20 0.56
HCRTR1 O43613 1/20 0.56
TSHR P16473 1/20 0.49
ATM Q13315 1/20 0.46
ALOX5 P09917 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43

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 0.83 NPC1 (0.64) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL24155569 0.80 NPC1 (0.60) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL3190644 0.80 NPC1 (0.60) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL21674269 0.80 NPC1 (0.63) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL4146821 0.80 NPC1 (0.50) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL26023364 0.79 NPC1 (0.58) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL25011928 0.79 NPC1 (0.58) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL824375 0.78 NPC1 (0.69) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL29531707 0.78 NPC1 (0.69) NPC1HSD17B10ALDH1A1RAB9ATP53
SCHEMBL23303865 0.77 NPC1 (0.69) NPC1HSD17B10ALDH1A1RAB9ATP53

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-11812659-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-07 US disclosed
US-11812659-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-07 US disclosed
WO-2021230512-A1 BENZAZOLE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 랩토 2021-11-18 WO disclosed
US-20210098715-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-04-01 US disclosed
CN-112582558-A Organic electroluminescent element and polycyclic compound for organic electroluminescent element 三星显示有限公司 2021-03-30 CN disclosed
EP-2681970-B1 POROUS FILMS FOR USE IN LIGHT-EMITTING DEVICES NITTO DENKO CORP (JP) 2018-01-17 EP 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
WO-2012119111-A1 POROUS FILMS FOR USE IN LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-09-07 WO disclosed
US-20120223635-A1 POROUS FILMS FOR USE IN LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-09-06 US disclosed
US-20120223635-A1 POROUS FILMS FOR USE IN LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-09-06 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-2007039146-A1 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-12 WO disclosed
WO-2007039146-A1 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-12 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 4104/4885HSD17B10 4588/4885ALDH1A1 867/4885

“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.