SCHEMBL9216178

SCHEMBL9216178

CNC(=S)[C@]1(c2cccnc2)CCCC[C@H]1CCNS(=O)(=O)c1cccnc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
CNR1 P21554 1/20 0.35
NAMPT P43490 3/20 0.35
ALDH1A1 P00352 2/20 0.35
PKM P14618 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
TBXAS1 P24557 1/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
BMP1 P13497 1/20 0.33
NLRP3 Q96P20 1/20 0.33
KMT2A Q03164 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL9217641 1.00 MAPK1 (0.39) MAPK1SMN1; SMN2LMNATSHRHTT
SCHEMBL9212010 0.96 MAPK1 (0.42) MAPK1SMN1; SMN2LMNATSHRHTT
SCHEMBL9216674 0.92 SLC6A2 (0.36) SMN1; SMN2LMNATSHRHTTNAMPT
SCHEMBL9211128 0.92 TBXAS1 (0.40) SMN1; SMN2LMNATSHRHTTNAMPT
SCHEMBL9213166 0.92 KDM4E (0.41) SMN1; SMN2LMNATSHRHTTCNR1
SCHEMBL9220380 0.92 KDM4E (0.41) SMN1; SMN2LMNATSHRHTTCNR1
SCHEMBL9211118 0.92 TBXAS1 (0.40) SMN1; SMN2LMNATSHRHTTNAMPT
SCHEMBL9212826 0.91 MAPK1 (0.38) MAPK1SMN1; SMN2LMNATSHRHTT
SCHEMBL9212029 0.91 ALDH1A1 (0.43) SMN1; SMN2LMNATSHRHTTNAMPT
SCHEMBL9216984 0.91 ALDH1A1 (0.43) SMN1; SMN2LMNATSHRHTTNAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510028-B1 THIOFORMAMIDE DERIVATIVES RHONE POULENC RORER SA (FR) 1995-03-15 EP claimed
US-5364853-A Treatment of disorders associated with vascular, respiratory, gastrointestinal tract, urinary bladder or uterus smooth muscle contraction RHONE-POULENC RORER LIMITED (GB) 1994-11-15 US claimed
EP-0510028-B1 THIOFORMAMIDE DERIVATIVES RHONE POULENC RORER SA (FR) 1995-03-15 EP disclosed
US-5364853-A Treatment of disorders associated with vascular, respiratory, gastrointestinal tract, urinary bladder or uterus smooth muscle contraction RHONE-POULENC RORER LIMITED (GB) 1994-11-15 US disclosed
EP-0510028-A1 THIOFORMAMIDE DERIVATIVES. RHONE POULENC RORER SA (FR) 1992-10-28 EP disclosed
WO-1991010652-A1 THIOFORMAMIDE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1991-07-25 WO disclosed