SCHEMBL20799747

SCHEMBL20799747

CCOC(=O)c1cc(-c2ccc(Cl)cc2Cl)c(C(=O)OCC)cc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 2/20 0.50
GABRB2 P47870 2/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
MAPT P10636 3/20 0.49
TSHR P16473 3/20 0.49
HSD17B10 Q99714 3/20 0.49
RAB9A P51151 2/20 0.49
POLB P06746 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.48
CYP1A2 P05177 3/20 0.48
CYP2C19 P33261 2/20 0.48
KDM4E B2RXH2 2/20 0.48
XBP1 P17861 1/20 0.48
CDC7 O00311 1/20 0.46
DBF4 Q9UBU7 1/20 0.46
CSF1R P07333 1/20 0.46
CNR1 P21554 2/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL20799790 0.95 GABRA2 (0.48) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806394 0.91 ALDH1A1 (0.49) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806416 0.90 CYP1A2 (0.48) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL24633216 0.90 GABRA2 (0.44) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL4276707 0.89 TSHR (0.54) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806414 0.88 TSHR (0.50) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20806424 0.86 RAB9A (0.49) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20806332 0.86 KDM4E (0.49) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20799792 0.86 TP53 (0.51) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806415 0.85 CYP1A2 (0.53) GABRA2GABRB2SMN1; SMN2MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
EP-3679024-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-11-02 EP disclosed
EP-3679023-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-11-02 EP disclosed
US-20200283386-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-09-10 US disclosed
WO-2019048458-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-03-14 WO disclosed
WO-2019048443-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-03-14 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 (2 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-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES SOD1, GPX1, EFNA1 GABRA2 2487/4885GABRB2 2257/4885SMN1; SMN2 2490/4885
US-20200283386-A1 MATERIALS FOR ELECTRONIC DEVICES EFNA1, GPX1, SOD1 GABRA2 2621/4885GABRB2 2323/4885SMN1; SMN2 2723/4885

“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.