SCHEMBL8549795

SCHEMBL8549795

O=C(O)c1c[n+]([O-])ccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DTYMK P23919 1/20 0.47
TSHR P16473 3/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CASP6 P55212 2/20 0.41
ALDH1A1 P00352 3/20 0.40
POLB P06746 2/20 0.38
CDC25B P30305 1/20 0.38
HCAR3 P49019 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.38
CTSD P07339 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
DNA2 P51530 1/20 0.37
CTDSP1 Q9GZU7 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
SCHEMBL28250511 0.77 ALDH1A1 (0.48) TSHRMEN1KMT2AMAPTALDH1A1
SCHEMBL15804255 0.77 CYP3A4 (0.39) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL1015021 0.77 MEN1 (0.50) MEN1KMT2AMAPTL3MBTL1ALDH1A1
SCHEMBL1015022 0.77 MEN1 (0.50) MEN1KMT2AMAPTL3MBTL1ALDH1A1
SCHEMBL10547254 0.76 GPR35 (0.46) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL8800977 0.75 ALDH1A1 (0.37) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL8847188 0.73 MEN1 (0.47) TSHRMEN1KMT2ATDP1CASP6
SCHEMBL4881052 0.72 MEN1 (0.46) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL3059949 0.72 TSHR (0.47) TSHRTDP1
SCHEMBL8568031 0.72 TDP1 (0.47) TSHRMEN1KMT2AMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0397474-B1 Photosensitive composition TOSHIBA KK (JP) 1997-12-10 EP claimed
US-5100768-A Photoresists for integrated circuits, polyvinyl phenol and nitrogen containing heterocycle KABUSHIKI KAISHA TOSHIBA (JP) 1992-03-31 US claimed
EP-0397474-A2 Photosensitive composition KABUSHIKI KAISHA TOSHIBA (JP) 1990-11-14 EP claimed
CN-105713524-A Silicone sealant for stone curtain wall 烟台图文马克化工科技有限公司 2016-06-29 CN disclosed
CN-101405277-A Dicarbonylic compounds with antibacterial activity SALVAT LAB SA (ES) 2009-04-08 CN disclosed
EP-0714393-B1 THIAZOLES AS ANTIVIRAL PFIZER (US) 1998-09-23 EP disclosed
US-5789408-A Antiviral thiazoles PFIZER INC. (US) 1998-08-04 US disclosed
EP-0397474-B1 Photosensitive composition TOSHIBA KK (JP) 1997-12-10 EP disclosed
EP-0714393-A1 THIAZOLES AS ANTIVIRAL PFIZER INC. (US) 1996-06-05 EP disclosed
WO-1995005378-A1 ANTIVIRAL THIAZOLES PFIZER INC. (US) 1995-02-23 WO disclosed
US-5100768-A Photoresists for integrated circuits, polyvinyl phenol and nitrogen containing heterocycle KABUSHIKI KAISHA TOSHIBA (JP) 1992-03-31 US disclosed
EP-0397474-A2 Photosensitive composition KABUSHIKI KAISHA TOSHIBA (JP) 1990-11-14 EP disclosed