SCHEMBL22109072

SCHEMBL22109072

N#CC(C#N)=C1c2cc3ccccc3cc2-c2c1c(F)c(F)c1c2C(=C(C#N)C#N)c2cc3ccccc3cc2-1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HPRT1 P00492 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
SCHEMBL470766 0.90 ALDH1A1 (0.38) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL22109492 0.90 MAPT (0.35) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL12149375 0.81 ALDH1A1 (0.35) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL12117667 0.81 ALDH1A1 (0.35) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL26332369 0.77 PDK2 (0.35) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL22109421 0.76 MAPT (0.40) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL26332396 0.76 HPRT1 (0.30) HPRT1
SCHEMBL20779056 0.76 MAPT (0.36) ALDH1A1GAAMAPTPKMHPRT1
SCHEMBL20779058 0.73 ALDH1A1 (0.30) ALDH1A1GAAMAPTPKM
SCHEMBL22109420 0.73 HPRT1 (0.30) HPRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767299-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-09-26 US disclosed
US-11767299-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-09-26 US disclosed
US-20200190039-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-06-18 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-20200190039-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM ALDH1A1 33/4885GAA 2385/4885MAPT 1878/4885
US-11767299-B2 Materials for organic electroluminescent devices L1CAM, EFNA1, EPCAM ALDH1A1 33/4885GAA 2385/4885MAPT 1878/4885

“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.