SCHEMBL11068574

SCHEMBL11068574

O=C1NC(=O)C(c2ccccc2-c2ccc(O)cc2)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
ABCB1 P08183 1/20 0.39
BCR P11274 1/20 0.39
GAA P10253 2/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.37
KDM4E B2RXH2 2/20 0.37
PTPN1 P18031 1/20 0.36
BACE1 P56817 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
APAF1 O14727 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
BLM P54132 1/20 0.36
MAPK10 P53779 1/20 0.36
RET P07949 1/20 0.36
FLT3 P36888 1/20 0.36

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
SCHEMBL11056072 0.81 MAPT (0.48) ABL1ABCB1BCRKDM4EPTPN1
SCHEMBL11566163 0.77 TDP1 (0.52) ABL1TDP1GAAKMT2AMEN1
SCHEMBL6277589 0.77 TDP1 (0.52) ABL1TDP1GAAKMT2AMEN1
SCHEMBL30023288 0.74 GAA (0.57) ABL1TDP1GAAKMT2AMEN1
SCHEMBL11652329 0.74 GAA (0.57) ABL1TDP1GAAKMT2AMEN1
SCHEMBL28470699 0.73 TDP1 (0.67) TDP1GAAKMT2AKDM4EALDH1A1
SCHEMBL1014744 0.73 TDP1 (0.67) TDP1GAAKMT2AKDM4EALDH1A1
SCHEMBL6475331 0.72 KMT2A (0.46) ABL1TDP1ABCB1BCRGAA
SCHEMBL10749005 0.71 TDP1 (0.42) ABL1TDP1GAAKMT2AMEN1
SCHEMBL11653951 0.71 GAA (0.44) TDP1GAAKMT2AMEN1KDM4E

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
US-4486344-A CARBONYLDIIMIDAZOLE AS LINKING AGENT, IMMUNOASSY MILES LABORATORIES, INC. (US) 1984-12-04 US disclosed
EP-0123114-A1 Urea-linked immunogens, antibodies, and preparative method MILES LABORATORIES, INC. (US) 1984-10-31 EP disclosed