SCHEMBL7692776

SCHEMBL7692776

O=C1Cc2ccccc2N1NBr

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
NOTUM Q6P988 1/20 0.47
CASP6 P55212 2/20 0.44
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
KMT2A Q03164 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
OPRM1 P35372 3/20 0.39
OPRK1 P41145 3/20 0.39
OPRL1 P41146 3/20 0.39
HTR7 P34969 3/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
RNASEH1 O60930 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL2832790 0.81 HPGD (0.50) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL1464486 0.75 HPGD (0.57) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL30642159 0.75 HPGD (0.57) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL5623519 0.75 NOTUM (0.46) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL7476038 0.75 NOTUM (0.58) HPGDNOTUMCASP6KMT2ACASP3
SCHEMBL1290437 0.74 HPGD (0.44) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL8860170 0.74 NOTUM (0.45) HPGDNOTUMCASP6KMT2ACASP3
SCHEMBL5624894 0.73 HPGD (0.46) HPGDNOTUMCASP6KMT2AMEN1
SCHEMBL5624795 0.73 NOTUM (0.44) HPGDNOTUMCASP6DDB1CRBN
SCHEMBL8860183 0.73 CASP6 (0.51) HPGDNOTUMCASP6DDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469181-B1 PREPARING 2-OXINDOLES AND N-HYROXY-2- OXINDOLES VIA REDUCTION OF 2-NITROARYLMALONATE DIESTERS WITHOUT ISOLATION OF INTERMEDIATES CATALYTICA, INC. 2002-10-22 US disclosed
EP-0809631-A4 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA INC (US) 1998-07-08 EP disclosed
EP-0809631-A1 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA, INC. (US) 1997-12-03 EP disclosed
WO-1996023770-A1 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA, INC. (US) 1996-08-08 WO disclosed