SCHEMBL29919005

SCHEMBL29919005

Clc1ccc2oc3ccccc3c2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 8/20 0.77
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
MAPT P10636 3/20 0.59
HPGD P15428 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
ADORA3 P0DMS8 2/20 0.50
TNKS O95271 2/20 0.50
IDO1 P14902 2/20 0.49
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
BCAT1 P54687 1/20 0.47
GLA P06280 1/20 0.46
CYP3A4 P08684 1/20 0.46
PGAM1 P18669 1/20 0.46

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
SCHEMBL2281402 1.00 AHR (0.77) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL31596655 1.00 AHR (0.77) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL20321518 0.96 AHR (0.78) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL24849015 0.94 AHR (0.75) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL23314522 0.92 AHR (0.67) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL24789225 0.92 AHR (0.67) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL22815446 0.89 AHR (0.73) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL2282515 0.89 AHR (0.78) AHRKDM4EALDH1A1HPGDKMT2A
SCHEMBL24090334 0.88 AHR (0.67) AHRKDM4EALDH1A1MAPTHPGD
SCHEMBL24518969 0.88 AHR (0.66) AHRKDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595256-B2 Composition for organic electronic devices MERCK PATENT GMBH (DE) 2026-04-07 US disclosed
EP-4544889-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES Merck Patent GmbH (DE) 2025-04-30 EP disclosed
WO-2023247663-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-12-28 WO disclosed
US-20230080974-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-03-16 US disclosed
US-20220332724-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-10-20 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-20220332724-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES SLCO2B1, SLCO2A1, SLCO4C1 AHR 205/4885KDM4E 2623/4885ALDH1A1 1983/4885
US-12595256-B2 Composition for organic electronic devices ABCB7, CYP1B1, AHR AHR 3/4885KDM4E 1993/4885ALDH1A1 561/4885

“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.