SCHEMBL21717526

SCHEMBL21717526

c1ccc2c(c1)oc1cc3c4cc5c6ccccc6oc5c5c6ccccc6n(c3cc12)c45

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.39
MAOA P21397 2/20 0.36
MAPT P10636 6/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 1/20 0.36
CYP3A4 P08684 2/20 0.35
CASP7 P55210 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALPI P09923 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
CASP3 P42574 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL21717984 0.96 AHR (0.40) AHRMAOAMAPTMEN1KMT2A
SCHEMBL22356411 0.95 AHR (0.39) AHRMAOAMAPTMEN1KMT2A
SCHEMBL21717902 0.95 AHR (0.41) AHRMAOAMAPTMEN1KMT2A
SCHEMBL21889619 0.95 AHR (0.40) AHRMAOAMAPTMEN1KMT2A
SCHEMBL21717967 0.91 ALDH1A1 (0.40) AHRMAOAMAPTMEN1KMT2A
SCHEMBL21889618 0.89 AHR (0.40) AHRMAOAMAPTMEN1KMT2A
SCHEMBL23995594 0.89 AHR (0.41) AHRMAOAMAPTMEN1KMT2A
SCHEMBL24718964 0.87 ALDH1A1 (0.36) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21717525 0.86 AHR (0.41) AHRMAOAMAPTMEN1KMT2A
SCHEMBL21126752 0.85 AHR (0.37) AHRMAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11839153-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device IDEMITSU KOSAN CO.,LTD. (JP) 2023-12-05 US disclosed
US-11839153-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device IDEMITSU KOSAN CO.,LTD. (JP) 2023-12-05 US disclosed
US-20200266361-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-08-20 US disclosed
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 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 (3 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-11839153-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device RER1, RPS19, RPL19 AHR 2471/4885MAOA 1884/4885MAPT 2777/4885
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE LEF1, L1CAM, ESR2 AHR 3288/4885MAOA 2783/4885MAPT 1866/4885
US-20200266361-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE RER1, RPS19, RPL19 AHR 2471/4885MAOA 1884/4885MAPT 2777/4885

“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.