SCHEMBL2086646

SCHEMBL2086646

c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.55
GPR84 Q9NQS5 10/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
MPI P34949 1/20 0.47
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
RECQL P46063 1/20 0.41
CES1 P23141 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL29682050 1.00 ALOX5 (0.55) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL30543005 0.82 MEN1 (0.52) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL2725777 0.82 MEN1 (0.52) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL15366767 0.82 MEN1 (0.52) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL29591632 0.81 ALOX5 (0.59) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL2709851 0.81 ALOX5 (0.59) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL31369138 0.81 GPR84 (0.42) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL300507 0.81 ALOX5 (0.57) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL29362847 0.81 ALOX5 (0.57) ALOX5GPR84MEN1KMT2AKDM4E
SCHEMBL2084490 0.80 ALOX5 (0.58) ALOX5GPR84MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020209307-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ELECTRONIC DEVICE, AND COMPOUND 出光興産株式会社 2020-10-15 WO disclosed
WO-2020209309-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE COMPRISING SAME 出光興産株式会社 2020-10-15 WO disclosed
WO-2020209310-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE COMPRISING SAME 出光興産株式会社 2020-10-15 WO disclosed
US-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2011-03-03 US disclosed
US-7790892-B2 Aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-09-07 US disclosed
US-20050214565-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2005-09-29 US disclosed
EP-1496041-A1 NOVEL AROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCNET ELEMENT CONTAINING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2005-01-12 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-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same TYR, EML4, TCF7L2 ALOX5 3307/4885GPR84 3527/4885MEN1 2095/4885

“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.