SCHEMBL20437429

SCHEMBL20437429

Cc1ccc2c(c1)c1ccccc1n2-c1cc(C#N)cc(-c2cc(C#N)cc(-n3c4ccccc4c4cc(C)ccc43)c2-n2c3ccccc3c3cc(C)ccc32)c1-n1c2ccccc2c2cc(C)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
RORC P51449 8/20 0.34
LMNA P02545 2/20 0.34
HTT P42858 2/20 0.34
PTGER4 P35408 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
METAP2 P50579 1/20 0.33
F2 P00734 1/20 0.32
PLAU P00749 1/20 0.32
ELANE P08246 1/20 0.32
CTRB1 P17538 1/20 0.32

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
SCHEMBL20061222 0.88 KDM4E (0.34) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL20061235 0.86 ALDH1A1 (0.38) BCHEACHEKDM4EALDH1A1
SCHEMBL25513395 0.85 BCHE (0.40) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL18374381 0.85 CASP3 (0.38) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL20437444 0.84 METAP2 (0.38) KDM4EALDH1A1HSD17B10L3MBTL1RORC
SCHEMBL20792040 0.84 RORC (0.35) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL22251528 0.83 MAPT (0.39) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL20061224 0.83 RORC (0.38) BCHEACHEMAPTKDM4EALDH1A1
SCHEMBL19809918 0.82 IMPDH2 (0.40) MAPTKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL26776568 0.81 GRM2 (0.38) BCHEACHEMAPTKDM4EALDH1A1

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-20180215711-A1 DOPANT FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-08-02 US disclosed
US-20180215711-A1 DOPANT FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-08-02 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-20180215711-A1 DOPANT FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD1, AOX1, AOC2 BCHE 2035/4885ACHE 1046/4885MAPT 862/4885

“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.