SCHEMBL3733885

SCHEMBL3733885

O=NN(O)c1ccc(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FSCN1 Q16658 1/20 0.50
TSHR P16473 6/20 0.40
HSD17B10 Q99714 2/20 0.40
CASP1 P29466 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 2/20 0.39
TDP1 Q9NUW8 4/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPK1 P28482 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HIF1A Q16665 1/20 0.36
CYP3A4 P08684 4/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGAV P06756 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
SCHEMBL30627905 1.00 FSCN1 (0.50) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL30627908 0.84 ALDH1A1 (0.40) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL3736685 0.84 ALDH1A1 (0.40) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL9772464 0.82 HSD17B10 (0.43) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL3732744 0.81 ALDH1A1 (0.42) FSCN1TSHRTP53ALDH1A1MAPK1
SCHEMBL3733899 0.75 LMNA (0.38) TSHRALDH1A1MEN1KMT2ALMNA
SCHEMBL4312691 0.71 TP53 (0.52) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL6231652 0.70 CA1 (0.42) TSHRHSD17B10SMN1; SMN2TP53TDP1
SCHEMBL10485955 0.69 FSCN1 (0.56) FSCN1TSHRHSD17B10CASP1SMN1; SMN2
SCHEMBL16914887 0.69 FSCN1 (0.51) FSCN1TSHRHSD17B10CASP1SMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814519-B2 Nitric oxide-releasing 3D-printing compositions and uses thereof VIRGINIA COMMONWEALTH UNIVERSITY (US) 2023-11-14 US disclosed
US-20210301135-A1 NITRIC OXIDE-RELEASING 3D-PRINTING COMPOSITIONS AND USES THEREOF VIRGINIA COMMONWEALTH UNIVERSITY 2021-09-30 US disclosed
US-20100196517-A1 TOPICAL DELIVERY OF A NITRIC OXIDE DONOR TO IMPROVE BODY AND SKIN APPEARANCE STRATEGIC SCIENCE & TECHNOLOGIES, LLC (US) 2010-08-05 US disclosed
EP-1732577-A4 TOPICAL DELIVERY OF A NITRIC OXIDE DONOR TO IMPROVE BODY AND SKIN APPEARANCE STRATEGIC SCIENCE & TECHNOLOGI (US) 2009-03-18 EP disclosed
US-20080045909-A1 Topical Delivery of a Nitric Oxide Donor to Improve and Skin Appearance STRATEGIC SCIENCE & TECHNOLOGIES, LLC. (US) 2008-02-21 US disclosed
EP-1732577-A2 TOPICAL DELIVERY OF A NITRIC OXIDE DONOR TO IMPROVE BODY AND SKIN APPEARANCE Strategic Science & Technologies, LLC (US) 2006-12-20 EP disclosed
WO-2005081964-A2 TOPICAL DELIVERY OF A NITRIC OXIDE DONOR TO IMPROVE BODY AND SKIN APPEARANCE STRATEGIC SCIENCE & TECHNOLOGIES, LLC (US) 2005-09-09 WO disclosed
WO-1996036326-A1 N-NITROSO-N-SUBSTITUTED HYDROXYLAMINES AS NITRIC OXIDE DONORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1996-11-21 WO disclosed