SCHEMBL9846401

SCHEMBL9846401

CCOC(=O)C(OCC)Oc1cccc(-c2ccsc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.43
USP2 O75604 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
CDC7 O00311 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
RXRA P19793 2/20 0.39
RXRB P28702 2/20 0.39
P2RX3 P56373 1/20 0.39
CTSK P43235 1/20 0.38
HTR1A P08908 1/20 0.38
CNR1 P21554 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL9258359 0.79 F9 (0.54) CHEK2HSD17B10MAPTHRH2HRH1
SCHEMBL30963937 0.75 RXRA (0.51) CHEK2MAPTPRMT6RXRARXRB
SCHEMBL28294058 0.75 CHEK2 (0.53) CHEK2USP2HSD17B10MEN1MAPT
SCHEMBL9258332 0.74 F9 (0.45) CHEK2HSD17B10MAPTKMT2AHRH2
SCHEMBL5702207 0.72 MGLL (0.53)
SCHEMBL9256522 0.72 PRMT6 (0.48) CHEK2USP2KMT2APRMT6RXRA
SCHEMBL9258419 0.71 P2RX3 (0.44) CHEK2PRMT6P2RX3HTR1ACNR1
SCHEMBL7871362 0.71 KAT6A (0.48) CHEK2USP2HSD17B10MEN1MAPT
SCHEMBL9261099 0.70 LMNA (0.53) HSD17B10MEN1ALOX15KMT2ARXRA
SCHEMBL5504603 0.70 HDAC1 (0.45) KDM4E

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-0448078-A2 Substituted amine derivatives having anti-hyperlipemia activity BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-09-25 EP disclosed