SCHEMBL25818433

SCHEMBL25818433

CC1(C)c2ccc(-c3ccccc3Br)cc2-c2ccc(Cl)cc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.38
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
AKR1A1 P14550 1/20 0.35
AKR1B1 P15121 1/20 0.35
GCGR P47871 1/20 0.34
MAPK14 Q16539 1/20 0.34
PGR P06401 4/20 0.34
S100A4 P26447 1/20 0.32
PTGES O14684 1/20 0.31

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
SCHEMBL25818397 0.94 PDK2 (0.41) PDK2ALDH1A1MAPK1AKR1A1AKR1B1
SCHEMBL19869566 0.87 ALDH1A1 (0.44) PDK2ALDH1A1MAPK1
SCHEMBL31461588 0.87 ALDH1A1 (0.44) PDK2ALDH1A1MAPK1
SCHEMBL29577059 0.84 ALDH1A1 (0.44) PDK2ALDH1A1MAPK1
SCHEMBL14508335 0.84 ALDH1A1 (0.44) PDK2ALDH1A1MAPK1
SCHEMBL29789018 0.84 ALDH1A1 (0.44) PDK2ALDH1A1MAPK1
SCHEMBL16475932 0.83 PDK2 (0.38) PDK2AKR1A1AKR1B1PGRS100A4
SCHEMBL22920886 0.83 PDK2 (0.41) PDK2ALDH1A1MAPK1AKR1A1AKR1B1
SCHEMBL27241792 0.82 PGR (0.43) PDK2PGR
SCHEMBL14508322 0.82 ALDH1A1 (0.45) PDK2ALDH1A1MAPK1

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 PDK2 1256/4885ALDH1A1 489/4885MAPK1 1159/4885

“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.