SCHEMBL7470029

SCHEMBL7470029

COC(=O)c1cccc(F)c1.O=S(=O)(O)Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
LMNA P02545 1/20 0.58
MRGPRX4 Q96LA9 1/20 0.55
POLB P06746 2/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL27403802 0.95 KMT2A (0.60) KMT2AMEN1LMNAMRGPRX4POLB
SCHEMBL17070601 0.90 KMT2A (0.69) KMT2AMEN1LMNAMRGPRX4POLB
SCHEMBL29570653 0.90 KMT2A (0.69) KMT2AMEN1LMNAMRGPRX4POLB
SCHEMBL1056526 0.90 KMT2A (0.69) KMT2AMEN1LMNAMRGPRX4POLB
Hydrochloric Acid SCHEMBL30779154 0.88 KMT2A (0.67) KMT2AMEN1LMNAMRGPRX4POLB
SCHEMBL7467547 0.83 POLB (0.55) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL7475311 0.83 NPC1 (0.49) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL7471102 0.83 POLB (0.54) LMNAPOLBNPC1SMN1; SMN2CA12
SCHEMBL7470758 0.82 GPR17 (0.56) POLBNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7471305 0.81 LMNA (0.54) LMNAPOLBNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859774-B1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 2002-04-03 EP disclosed
EP-0977756-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2000-02-09 EP disclosed
WO-1998049166-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 1998-11-05 WO disclosed
EP-0859774-A1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 1998-08-26 EP disclosed