SCHEMBL5347018

SCHEMBL5347018

c1ccc(-c2nc3ccccn3c2-c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.66
RAB9A P51151 3/20 0.66
AKT1 P31749 1/20 0.65
AKT2 P31751 1/20 0.65
ADRA1B P35368 1/20 0.55
NTRK1 P04629 1/20 0.55
HSP90AA1 P07900 1/20 0.53
HSP90AB1 P08238 1/20 0.53
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 5/20 0.50
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.50
GLA P06280 2/20 0.50
GAA P10253 2/20 0.50
USP7 Q93009 2/20 0.50
MAPT P10636 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49

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
SCHEMBL19953862 0.96 AKT1 (0.66) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL13599904 0.96 AKT1 (0.66) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL24479406 0.93 AKT1 (0.63) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL25789353 0.93 AKT1 (0.63) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL15382793 0.93 AKT1 (0.63) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL22673418 0.93 AKT1 (0.63) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL13131134 0.93 AKT1 (0.58) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL24479218 0.92 AKT1 (0.61) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL22673697 0.92 AKT1 (0.61) NPC1RAB9AAKT1AKT2ADRA1B
SCHEMBL24479413 0.92 AKT1 (0.61) NPC1RAB9AAKT1AKT2ADRA1B

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230292595-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-09-14 US disclosed
US-20230292595-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-09-14 US disclosed
US-20230270004-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-08-24 US disclosed
US-20230270004-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-08-24 US disclosed
US-20230225201-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-07-13 US disclosed
US-20230225201-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-07-13 US disclosed
EP-4198103-A1 ORGANIC LIGHT EMITTING DIODE AND DEVICE COMPRISING THE SAME Novaled GmbH (DE) 2023-06-21 EP disclosed
EP-4141979-A1 ORGANIC LIGHT EMITTING DIODE AND A COMPOUND FOR USE THEREIN Novaled GmbH (DE) 2023-03-01 EP disclosed
EP-4141980-A1 ORGANIC LIGHT EMITTING DIODE AND A COMPOUND FOR USE THEREIN Novaled GmbH (DE) 2023-03-01 EP disclosed
WO-2021250279-A1 ORGANIC LIGHT EMITTING DIODE AND DEVICE COMPRISING THE SAME NOVALED GMBH (DE) 2021-12-16 WO disclosed
US-9926316-B2 Antitumor derivatives for differentiation therapy THE CLEVELAND CLINIC FOUNDATION (US) 2018-03-27 US disclosed
US-20170253589-A1 ANTITUMOR DERIVATIVES FOR DIFFERENTIATION THERAPY THE CLEVELAND CLINIC FOUNDATION 2017-09-07 US disclosed
US-9012042-B2 Condensed-cyclic compound, organic light-emitting device comprising the same, and flat panel display apparatus SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-21 US disclosed
US-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-11-15 US disclosed
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-7632578-B2 Emitting compound for organic electroluminescent device and organic electroluminescent device using the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2009-12-15 US disclosed
US-7632578-B2 Emitting compound for organic electroluminescent device and organic electroluminescent device using the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2009-12-15 US disclosed
WO-2007129169-A2 COX- II INHIBITORS FOR IMPROVING REPRODUCTIVE SUCCESS IN A FEMALE ANIMAL PFIZER LIMITED (GB) 2007-11-15 WO disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed
US-4186205-A ANTIARTHRITIC AGENTS SMITHKLINE CORPORATION (US) 1980-01-29 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 (2 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-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS OR10J3, AR, ARL1 NPC1 2555/4885RAB9A 1129/4885AKT1 3179/4885
US-20170253589-A1 ANTITUMOR DERIVATIVES FOR DIFFERENTIATION THERAPY MYD88, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS NPC1 3167/4885RAB9A 1723/4885AKT1 2560/4885

“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.