SCHEMBL24039367

SCHEMBL24039367

c1ccc2c(c1)-c1ccccc1C1(c3ccccc3-2)c2ccccc2-c2c(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)cccc21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.33
ALOX5 P09917 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
HCRTR1 O43613 1/20 0.32
GAA P10253 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTR2B P41595 1/20 0.31
PRKDC P78527 1/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL24039709 0.96 AHR (0.35) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL25068743 0.94 AHR (0.36) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039364 0.94 CHEK2 (0.34) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24794920 0.93 ALOX5 (0.33) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039677 0.92 AHR (0.33) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039487 0.92 AHR (0.36) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039579 0.91 MMP12 (0.33) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039173 0.91 KDM4E (0.36) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039217 0.91 KDM4E (0.36) AHRALOX5KDM4EALDH1A1HPGD
SCHEMBL24039860 0.91 PDK2 (0.33) KDM4EALDH1A1HPGDMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11183641-B2 Composition for an organic electronic device and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2021-11-23 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 (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-11183641-B2 Composition for an organic electronic device and organic electronic device using the same ORC3, ZYX, ESR1 AHR 653/4885ALOX5 2066/4885KDM4E 1354/4885

“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.