SCHEMBL22011541

SCHEMBL22011541

c1ccc2c(c1)sc1ccc3c(c12)c1c2ccccc2sc1c1c2ccccc2n(-c2ccc4c5ccccc5c5ccccc5c4c2)c31

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.32
MAPT P10636 5/20 0.32
RXFP1 Q9HBX9 1/20 0.32
GPR3 P46089 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL24172271 0.91 TP53 (0.32) TP53MAPTRXFP1GPR3ALDH1A1
SCHEMBL22011429 0.89 ATM (0.39) TP53MAPTRXFP1GPR3ALDH1A1
SCHEMBL17405423 0.89 TP53 (0.35) TP53MAPTRXFP1GPR3ALDH1A1
SCHEMBL22011548 0.89 KDM4E (0.39) TP53MAPTRXFP1
SCHEMBL24171454 0.88 KDM4E (0.38) TP53MAPTRXFP1
SCHEMBL16275606 0.87 TP53 (0.36) TP53MAPTRXFP1GPR3ALDH1A1
SCHEMBL17405839 0.87 TP53 (0.36) TP53MAPTRXFP1GPR3ALDH1A1
SCHEMBL24172319 0.87 KDM4E (0.36) TP53
SCHEMBL17405872 0.86 ATM (0.39) TP53MAPTRXFP1ALDH1A1
SCHEMBL17406208 0.86 ATM (0.39) TP53MAPTRXFP1ALDH1A1

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-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
EP-3880682-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed
US-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-01-06 US disclosed
WO-2020099307-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-05-22 WO 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-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES ZYX, RER1, AOC2 TP53 4142/4885MAPT 4261/4885RXFP1 897/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 TP53 4142/4885MAPT 4261/4885RXFP1 897/4885

“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.