SCHEMBL9263145

SCHEMBL9263145

CS(=O)(=O)c1ccc(/C(CCCCCCn2ccnc2)=N\O)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 10/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 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
SCHEMBL9263151 1.00 TBXAS1 (0.49) TBXAS1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL9266639 0.88 TBXAS1 (0.46) TBXAS1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL9266643 0.88 TBXAS1 (0.46) TBXAS1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL9268521 0.85 TBXAS1 (0.69) TBXAS1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL10567974 0.81 QPCT (0.50) TBXAS1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL9260322 0.81 MEN1 (0.56) TBXAS1ALDH1A1KMT2ALMNAATM
SCHEMBL10567981 0.81 QPCT (0.50) TBXAS1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL9260327 0.81 MEN1 (0.56) TBXAS1ALDH1A1KMT2ALMNAATM
SCHEMBL9263044 0.75 TBXAS1 (0.52) TBXAS1ALDH1A1
SCHEMBL8538923 0.75 KDM4E (0.67) SMN1; SMN2KMT2ALMNAATMCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 EP claimed
US-5459144-A Enterovirus and rhinovirus antiviral, antiinflammatory and antagonist of platelet activating factor SCHERING CORPORATION (US) 1995-10-17 US disclosed
US-5272167-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-12-21 US disclosed
EP-0560407-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-09-15 EP disclosed
WO-1991000858-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS SCHERING CORPORATION (US) 1991-01-24 WO disclosed
EP-0407217-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1991-01-09 EP disclosed
US-4851423-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1989-07-25 US disclosed
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 EP disclosed