SCHEMBL10458402

SCHEMBL10458402

c1ccc2nc(Nc3ccc4ccccc4n3)ccc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.71
NPC1 O15118 9/20 0.58
RAB9A P51151 9/20 0.58
KDM4E B2RXH2 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
NFKB1 P19838 2/20 0.58
NFKB2 Q00653 2/20 0.58
RELA Q04206 2/20 0.58
ALDH1A1 P00352 1/20 0.58
GAA P10253 1/20 0.58
KMT2A Q03164 1/20 0.52
PKM P14618 1/20 0.51
NOS2 P35228 1/20 0.50
BACE1 P56817 1/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
CYP1A2 P05177 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL30760998 1.00 NCF1 (0.71) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL29833517 0.87 NCF1 (0.61) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL396525 0.87 NCF1 (0.61) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2844247 0.86 NPC1 (0.59) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1702119 0.86 NPC1 (0.59) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1703679 0.84 RAB9A (0.59) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1702196 0.83 NCF1 (0.57) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL9402367 0.83 NCF1 (0.52) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5806618 0.83 NCF1 (0.68) NCF1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5506476 0.83 NCF1 (1.00) NCF1NPC1RAB9AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56049320-A None JP disclosed
US-12029055-B2 OLED with hybrid emissive layer THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2024-07-02 US disclosed
US-11812624-B2 Organic electroluminescent materials and devices UNITED STATES DEPARTMENT OF ENERGY 2023-11-07 US disclosed
US-11812624-B2 Organic electroluminescent materials and devices UNITED STATES DEPARTMENT OF ENERGY 2023-11-07 US disclosed
US-11780829-B2 Organic electroluminescent materials and devices THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2023-10-10 US disclosed
US-11780829-B2 Organic electroluminescent materials and devices THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2023-10-10 US disclosed
EP-3690973-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES University Of Southern California (US) 2020-08-05 EP disclosed
US-20200239456-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNITED STATES DEPARTMENT OF ENERGY 2020-07-30 US disclosed
US-20200243772-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNITED STATES DEPARTMENT OF ENERGY 2020-07-30 US disclosed
US-20190237694-A1 OLED WITH HYBRID EMISSIVE LAYER UNITED STATES DEPARTMENT OF ENERGY 2019-08-01 US disclosed
US-9118024-B2 Electroluminescent devices having a color emitting galium complex ROYSTER TOMMIE (US) 2015-08-25 US disclosed
US-9118024-B2 Electroluminescent devices having a color emitting galium complex ROYSTER TOMMIE (US) 2015-08-25 US disclosed
US-8222634-B2 Anthracene derivatives and organic electronic device using the same LG CHEM, LTD. (KR) 2012-07-17 US disclosed
US-8222634-B2 Anthracene derivatives and organic electronic device using the same LG CHEM, LTD. (KR) 2012-07-17 US disclosed
US-20110024725-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2011-02-03 US disclosed
US-20110024725-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2011-02-03 US disclosed
WO-2008143440-A1 NEW ANTHRACENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2008-11-27 WO disclosed
JP-S5649320-A REMEDY FOR CARDIOVASCULAR DISEASE MOCHIDA PHARMACEUT CO LTD 1981-05-02 JP 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 (7 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-11812624-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, HCRTR2 NCF1 2856/4885NPC1 2977/4885RAB9A 2800/4885
US-12029055-B2 OLED with hybrid emissive layer S1PR4, S1PR1, S1PR2 NCF1 2338/4885NPC1 80/4885RAB9A 2619/4885
US-20110024725-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE USING THE SAME VDAC2, VDAC3, ANXA1 NCF1 2773/4885NPC1 3958/4885RAB9A 3509/4885
US-20200243772-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, HCRTR2 NCF1 2856/4885NPC1 2977/4885RAB9A 2800/4885
US-20190237694-A1 OLED WITH HYBRID EMISSIVE LAYER S1PR4, S1PR2, S1PR1 NCF1 2811/4885NPC1 95/4885RAB9A 2556/4885
US-20200239456-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, HCRTR2 NCF1 3110/4885NPC1 3384/4885RAB9A 2729/4885
US-11780829-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, HCRTR2 NCF1 3110/4885NPC1 3384/4885RAB9A 2729/4885

“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.