SCHEMBL25817444

SCHEMBL25817444

CC(C)(C)c1ccc2c(-c3ccccc3-c3ccccc3)nc(C(C)(C)C)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.38
ABCG2 Q9UNQ0 2/20 0.36
PLK4 O00444 1/20 0.36
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
CHUK O15111 1/20 0.36
PDPK1 O15530 1/20 0.36
JAK2 O60674 1/20 0.36
ROCK2 O75116 1/20 0.36
MAP4K4 O95819 1/20 0.36
PAK4 O96013 1/20 0.36
CHEK2 O96017 1/20 0.36
ABL1 P00519 1/20 0.36
NTRK1 P04629 1/20 0.36
PRKCG P05129 1/20 0.36
INSR P06213 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
CDK1 P06493 1/20 0.36
FES P07332 1/20 0.36

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
SCHEMBL18232172 0.86 ALDH1A1 (0.44) CDK1CDK2ALDH1A1PLA2G1BL3MBTL1
SCHEMBL25833574 0.83 ALDH1A1 (0.37) ALDH1A1PLA2G1BL3MBTL1ATG4BNPC1
SCHEMBL25817449 0.78 SRC (0.37) PLK4CHEK1AURKACHUKPDPK1
SCHEMBL25877823 0.76 ABCG2 (0.49) ABCG2PLK4CHEK1AURKACHUK
SCHEMBL25878131 0.74 ALDH1A1 (0.37) ALDH1A1PLA2G1BL3MBTL1ATG4BNFKB1
SCHEMBL25877803 0.74 TNKS (0.51) ABCG2ALDH1A1PLA2G1BL3MBTL1ATG4B
SCHEMBL16520903 0.73 ADORA2A (0.55) ALDH1A1PLA2G1BL3MBTL1ATG4BAKT1
SCHEMBL20052625 0.71 MEN1 (0.40) ABCG2CDK2ALDH1A1RAB9ALMNA
SCHEMBL25877827 0.71 ADORA2A (0.43) CDK1CDK2CLK4ALDH1A1PLA2G1B
SCHEMBL28364734 0.71 ESR1 (0.58) ABCG2CNR1CNR2AKT1AKT2

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-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 US disclosed
US-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 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-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME OR10J3, AOC2, EPCAM SCD 2497/4885ABCG2 3403/4885PLK4 4296/4885

“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.