SCHEMBL19760320

SCHEMBL19760320

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)sc1ccccc13

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RAB9A P51151 2/20 0.47
HPGD P15428 1/20 0.47
GPR3 P46089 1/20 0.47
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
OPRK1 P41145 1/20 0.37
KMT2A Q03164 1/20 0.37
ALOX5 P09917 1/20 0.35
CYP1A2 P05177 1/20 0.34
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33
PTPN22 Q9Y2R2 1/20 0.33

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
SCHEMBL18156881 0.93 MAPT (0.48) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL19886903 0.92 MAPT (0.44) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL22930728 0.92 MAPT (0.47) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL19195866 0.91 MAPT (0.41) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL24570193 0.91 MAPT (0.44) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL17516101 0.90 MAPT (0.40) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL13467604 0.90 GPR3 (0.47) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL13467607 0.90 ALDH1A1 (0.49) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL20224553 0.89 MAPT (0.39) MAPTALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL18732170 0.89 PDK2 (0.43) MAPTALDH1A1SMN1; SMN2RAB9AHPGD

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
EP-3238286-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-17 EP disclosed
US-10224492-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2019-03-05 US disclosed
US-20180006245-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-01-04 US disclosed