SCHEMBL4650948

SCHEMBL4650948

CCCCCCCCCCCCOc1c(C(=O)Nc2ccccc2C(=O)O)sc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 6/20 0.60
MAPT P10636 3/20 0.52
PLK3 Q9H4B4 3/20 0.51
PTPN1 P18031 4/20 0.51
AKR1C3 P42330 1/20 0.48
AKR1C2 P52895 1/20 0.48
AKR1C1 Q04828 1/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
CXCR2 P25025 1/20 0.47
MEN1 O00255 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
SENP5 Q96HI0 1/20 0.46
SENP2 Q9HC62 1/20 0.46
SENP1 Q9P0U3 1/20 0.46
PRSS12 P56730 1/20 0.46

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
SCHEMBL4651949 1.00 PLK1 (0.60) PLK1MAPTPLK3PTPN1AKR1C3
SCHEMBL4651954 1.00 PLK1 (0.60) PLK1MAPTPLK3PTPN1AKR1C3
SCHEMBL4651842 0.85 MAPT (0.48) PLK1MAPTPLK3AKR1C3AKR1C2
SCHEMBL4651616 0.84 CXCR2 (0.51) MAPTPTPN1ALDH1A1KDM4ECXCR2
SCHEMBL4652888 0.84 CXCR2 (0.51) MAPTPTPN1ALDH1A1KDM4ECXCR2
SCHEMBL4651710 0.84 CXCR2 (0.51) MAPTPTPN1ALDH1A1KDM4ECXCR2
SCHEMBL4651959 0.84 PLK1 (0.61) PLK1MAPTPLK3PTPN1AKR1C3
SCHEMBL4651952 0.84 PLK1 (0.61) PLK1MAPTPLK3PTPN1AKR1C3
SCHEMBL4650949 0.84 PLK1 (0.61) PLK1MAPTPLK3PTPN1AKR1C3
SCHEMBL9211107 0.81 PRSS12 (0.50) PLK1MAPTAKR1C3AKR1C2AKR1C1

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
EP-1972624-A1 Benzoxazinones and their use as ultraviolet light absorbers Clariant International Ltd. (CH) 2008-09-24 EP disclosed