SCHEMBL9409754

SCHEMBL9409754

O=C(CBr)c1ccccc1C(=O)CBr

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.65
GSK3B P49841 11/20 0.61
HPGDS O60760 1/20 0.50
ALOX15 P16050 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
CES1 P23141 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL1893853 0.91 ALDH1A1 (0.64) PTPN1GSK3BHPGDSALOX15ALDH1A1
SCHEMBL31519376 0.91 ALDH1A1 (0.64) PTPN1GSK3BHPGDSALOX15ALDH1A1
SCHEMBL1701142 0.85 PTPN1 (0.57) PTPN1GSK3BALDH1A1KDM4EMEN1
SCHEMBL166468 0.85 PTPN1 (0.57) PTPN1GSK3BHPGDSALDH1A1KDM4E
SCHEMBL29845700 0.85 PTPN1 (0.57) PTPN1GSK3BALDH1A1KDM4EMEN1
SCHEMBL8740774 0.85 PTPN1 (0.57) PTPN1GSK3BHPGDSALDH1A1KDM4E
SCHEMBL29758522 0.85 PTPN1 (0.57) PTPN1GSK3BHPGDSALDH1A1KDM4E
SCHEMBL10717789 0.85 PTPN1 (0.52) PTPN1GSK3BHPGDSALOX15ALDH1A1
SCHEMBL19266347 0.85 PTPN1 (0.52) PTPN1GSK3BHPGDSALOX15ALDH1A1
SCHEMBL166429 0.84 PTPN1 (0.58) PTPN1GSK3BALOX15ALDH1A1MEN1

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
EP-0620500-A2 Resist and pattern formation using the same HITACHI, LTD. (JP) 1994-10-19 EP claimed
EP-0620500-A2 Resist and pattern formation using the same HITACHI, LTD. (JP) 1994-10-19 EP disclosed