SCHEMBL19909164

SCHEMBL19909164

N#Cc1cccc(-c2ccc3c4ccccc4n(-c4cc(C#N)cc(-n5c6ccccc6c6ccc(-c7cccc(C#N)c7)cc65)c4-c4ccncc4)c3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CASP1 P29466 1/20 0.40
AURKA O14965 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
MAPK14 Q16539 2/20 0.38
FLT3 P36888 2/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
CLK4 Q9HAZ1 1/20 0.37
GRM5 P41594 3/20 0.37
ALDH1A3 P47895 1/20 0.37
CDC7 O00311 1/20 0.36
MAP4K4 O95819 1/20 0.36
ADORA2A P29274 1/20 0.36
TDO2 P48775 1/20 0.35
CTSD P07339 1/20 0.35

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
SCHEMBL19909476 0.95 AURKA (0.41) USP2CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL19909475 0.93 CYP1A2 (0.40) USP2CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL19909117 0.93 MAPK14 (0.39) USP2CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL19913150 0.93 MAPK14 (0.39) USP2CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL19909478 0.91 FLT3 (0.41) GSK3AGSK3BMAPK14FLT3CLK4
SCHEMBL25659076 0.91 ALDH1A3 (0.37) CYP1A2CYP3A4CYP2C9CLK4GRM5
SCHEMBL21546578 0.91 ALDH1A3 (0.38) CYP1A2CYP3A4CYP2C9CLK4GRM5
SCHEMBL19913160 0.90 MAPK14 (0.42) MAPK14FLT3GRM5MAP4K4
SCHEMBL21414161 0.90 ALDH1A3 (0.38) CYP1A2CYP3A4CYP2C9CLK4GRM5
SCHEMBL19913152 0.90 IMPDH2 (0.39) AURKAGSK3AGSK3BMAPK14FLT3

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-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 USP2 4431/4885CYP1A2 344/4885CYP3A4 339/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 USP2 3513/4885CYP1A2 2290/4885CYP3A4 1955/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 USP2 4431/4885CYP1A2 344/4885CYP3A4 339/4885

“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.