SCHEMBL9735393

SCHEMBL9735393

O=S(=O)(c1cccc(F)n1)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 2/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
GAA P10253 1/20 0.45
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
TSHR P16473 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
PKM P14618 1/20 0.43
DCUN1D1 Q96GG9 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL9734635 0.85 SMN1; SMN2 (0.47) HSD11B1KMT2AMEN1GAAUSP2
SCHEMBL9735682 0.84 TSHR (0.49) HSD11B1KMT2AMEN1USP2SMN1; SMN2
SCHEMBL9734308 0.81 TSHR (0.41) HSD11B1L3MBTL1TSHRKDM4ELMNA
SCHEMBL29467280 0.78 HSD11B1 (0.47) HSD11B1L3MBTL1POLBKMT2AMEN1
SCHEMBL9724526 0.76 HSD11B1 (0.46) HSD11B1L3MBTL1POLBKMT2AMEN1
SCHEMBL4708071 0.74 PKM (0.59) HSD11B1L3MBTL1POLBKMT2AMEN1
SCHEMBL3466241 0.74 HSD11B1 (0.51) HSD11B1PKM
SCHEMBL4580127 0.73 PKM (0.76) POLBKMT2AMEN1GAASMN1; SMN2
SCHEMBL12753843 0.72 HSD11B1 (0.58) HSD11B1
SCHEMBL9736020 0.72 L3MBTL1 (0.49) HSD11B1L3MBTL1POLBKMT2AMEN1

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-5137886-A Agriculture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-08-11 US disclosed
EP-0433001-A1 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-19 EP disclosed