SCHEMBL7385190

SCHEMBL7385190

Cc1nc2[nH]c(=O)[nH]c2cc1-c1ccc(NS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 10/20 0.58
PDE3A Q14432 10/20 0.58
HSPD1 P10809 1/20 0.42
HSPE1 P61604 1/20 0.42
PTPN11 Q06124 1/20 0.41
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTPN1 P18031 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CA2 P00918 2/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
CA1 P00915 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
SCHEMBL7377905 0.85 PDE3B (0.64) PDE3BPDE3AMEN1KMT2A
SCHEMBL7387266 0.81 MEN1 (0.59) PDE3BPDE3AHSPD1HSPE1MAPK1
SCHEMBL7383419 0.80 PDE3B (0.70) PDE3BPDE3A
SCHEMBL7383915 0.79 PDE3B (0.58) PDE3BPDE3ASMN1; SMN2MEN1KMT2A
SCHEMBL7378034 0.79 PDE3B (0.55) PDE3BPDE3APPARGPPARA
SCHEMBL7382397 0.77 PDE3B (0.53) PDE3BPDE3A
SCHEMBL7382885 0.76 PDE3B (0.72) PDE3BPDE3A
SCHEMBL7386282 0.76 PDE3B (0.72) PDE3BPDE3A
SCHEMBL7384334 0.76 PDE3B (0.64) PDE3BPDE3ASMN1; SMN2MEN1KMT2A
SCHEMBL7388786 0.76 PDE3B (0.51) PDE3BPDE3A

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-5010086-A Enzyme inhibitor for treating congestive heart failure or hypertension in mammals STERLING DRUG INC. (US) 1991-04-23 US disclosed
US-4963561-A Phosphodiesterase inhibitors STERLING DRUG INC. (US) 1990-10-16 US disclosed