SCHEMBL28514484

SCHEMBL28514484

O=C1C=C(c2c[nH]c3ccc(Br)cc23)C(=O)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.55
PTPRC P08575 3/20 0.55
PTPRF P10586 1/20 0.55
CDC25B P30305 1/20 0.55
CAMK2D Q13557 3/20 0.46
BACE1 P56817 2/20 0.46
S100A4 P26447 1/20 0.44
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
IGF1R P08069 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
TEK Q02763 1/20 0.42
GPR84 Q9NQS5 1/20 0.41
PIM1 P11309 2/20 0.41
CLK1 P49759 2/20 0.41

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
SCHEMBL28506037 0.84 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL9572016 0.83 PTPN1 (0.77) PTPN1PTPRCPTPRFCDC25BCAMK2D
SCHEMBL28516065 0.81 PTPN1 (0.51) PTPN1PTPRCPTPRFCDC25BCAMK2D
SCHEMBL28508263 0.81 PTPN1 (0.51) PTPN1PTPRCPTPRFCDC25BPDGFRB
SCHEMBL7737770 0.76 PDGFRB (0.44) PTPN1CAMK2DEGFRERBB2IGF1R
SCHEMBL28906711 0.76 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL28503581 0.76 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL28336963 0.75 PTPN1 (0.46) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL28503567 0.75 PTPN1 (0.46) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL20846072 0.74 GPR84 (0.47) CAMK2DGPR84PIM1CLK1CDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437124-B Preparation method of indoloquinone derivative 中国科学院成都有机化学有限公司 2020-12-22 CN disclosed