SCHEMBL20824922

SCHEMBL20824922

N#CC(C#N)=Cc1ccccc(C=C(C#N)C#N)cccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.80
ALDH1A1 P00352 10/20 0.80
MAPT P10636 10/20 0.80
MEN1 O00255 9/20 0.80
KDM4E B2RXH2 5/20 0.80
LMNA P02545 5/20 0.80
NPSR1 Q6W5P4 4/20 0.80
POLB P06746 2/20 0.80
THRB P10828 1/20 0.67
CISD1 Q9NZ45 1/20 0.67
EGFR P00533 6/20 0.64
MAPK1 P28482 2/20 0.61
CYP3A4 P08684 4/20 0.57
HPGD P15428 4/20 0.57
TSHR P16473 4/20 0.57
NFKB1 P19838 4/20 0.57
BLM P54132 4/20 0.57
PMP22 Q01453 4/20 0.57
CYP1A2 P05177 3/20 0.57
APEX1 P27695 1/20 0.57

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
SCHEMBL60843 0.97 MAPT (0.76) KMT2AALDH1A1MAPTMEN1KDM4E
Hydrochloric Acid SCHEMBL28271363 0.95 MAPT (0.73) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17466932 0.89 MAPT (1.00) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17466937 0.89 KMT2A (0.71) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL5865768 0.85 ALDH1A1 (0.65) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL953427 0.84 MAPT (0.58) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL5386096 0.84 MAPT (0.58) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL9985945 0.84 MAPT (0.58) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17466930 0.84 MAPT (0.71) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL5386095 0.84 MAPT (0.58) KMT2AALDH1A1MAPTMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369824-A1 ORGANIC SEMICONDUCTING COMPOUNDS Raynergy Tek Incorporation (TW) 2020-11-26 US disclosed
WO-2019052935-A1 ORGANIC SEMICONDUCTING COMPOUNDS MERCK PATENT GMBH (DE) 2019-03-21 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 (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-20200369824-A1 ORGANIC SEMICONDUCTING COMPOUNDS OCIAD2, OCIAD1, OSTC KMT2A 916/4885ALDH1A1 2672/4885MAPT 32/4885

“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.