SCHEMBL20799790

SCHEMBL20799790

CCOC(=O)c1cc(-c2ccccc2-c2ccccc2)c(C(=O)OCC)cc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 2/20 0.48
GABRB2 P47870 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 3/20 0.47
TSHR P16473 3/20 0.47
HSD17B10 Q99714 3/20 0.47
RAB9A P51151 2/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 2/20 0.46
KDM4E B2RXH2 2/20 0.46
XBP1 P17861 1/20 0.46
CDC7 O00311 1/20 0.44
DBF4 Q9UBU7 1/20 0.44
CSF1R P07333 1/20 0.44
CNR1 P21554 2/20 0.44
TP53 P04637 1/20 0.43

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
SCHEMBL20799747 0.95 GABRA2 (0.50) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806387 0.90 TSHR (0.49) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20799792 0.89 TP53 (0.51) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806394 0.89 ALDH1A1 (0.49) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL24633216 0.88 GABRA2 (0.44) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL4276707 0.87 TSHR (0.54) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806414 0.86 TSHR (0.50) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20806416 0.85 CYP1A2 (0.48) GABRA2GABRB2SMN1; SMN2MAPTTSHR
SCHEMBL20806332 0.84 KDM4E (0.49) SMN1; SMN2MAPTTSHRHSD17B10RAB9A
SCHEMBL20806424 0.84 RAB9A (0.49) SMN1; SMN2MAPTTSHRHSD17B10RAB9A

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 3 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-3679023-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-11-02 EP disclosed
WO-2019048458-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 (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-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES SOD1, GPX1, EFNA1 GABRA2 2487/4885GABRB2 2257/4885SMN1; SMN2 2490/4885

“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.