SCHEMBL11048383

SCHEMBL11048383

CC(=O)c1c(C)c(C)c([N+](=O)[O-])c([N+](=O)[O-])c1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 3/20 0.36
MAPK1 P28482 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GALR3 O60755 1/20 0.33
HTT P42858 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
IMPDH2 P12268 1/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL8589649 0.82 SMN1; SMN2 (0.36) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL113330 0.82 SMN1; SMN2 (0.36) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL22554339 0.79 NPC1 (0.35) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL14031699 0.77 SMN1; SMN2 (0.40) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL12348427 0.76 SMN1; SMN2 (0.39) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL12132440 0.76 SMN1; SMN2 (0.49) TDP1ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL1224154 0.73 TSHR (0.41) TDP1ALDH1A1TSHRSMN1; SMN2L3MBTL1
SCHEMBL27334468 0.72 TDP1 (0.37) TDP1ALDH1A1TSHRSMN1; SMN2MAPT
SCHEMBL27344248 0.71 ALDH1A1 (0.33) TDP1ALDH1A1TSHRSMN1; SMN2POLB
SCHEMBL2182723 0.70 ALDH1A1 (0.37) TDP1ALDH1A1TSHRSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4438245-A FOR LIGHT SENSITIVE ELEMENTS FUJI PHOTO FILM CO., LTD. (JP) 1984-03-20 US disclosed
US-4065430-A Functional group containing polymer and method of preparing the same FUJI PHOTO FILM CO., LTD. (JA) 1977-12-27 US disclosed
US-4060685-A Furanacroyl esters FUJI PHOTO FILM CO., LTD. (JA) 1977-11-29 US disclosed
US-4041017-A Reactive light-sensitive high polymer compound containing furyl pentadienic ester groups and insolubilized by action of heat, light or electron beams FUJI PHOTO FILM CO., LTD. (JA) 1977-08-09 US disclosed
US-3993624-A Light-sensitive high molecular weight compound capable of being cross-linked by irradiation with light or an electron beam FUJI PHOTO FILM CO., LTD. (JA) 1976-11-23 US disclosed
US-3945831-A Photosensitive resins containing a thienylacrylic acid ester or amide group FUJI PHOTO FILM CO., LTD. (JA) 1976-03-23 US disclosed
US-3936429-A Reactive polymer FUJI PHOTO FILM CO., LTD. (JA) 1976-02-03 US disclosed
US-3933885-A Cinnamylideneacetic acid esters FUJI PHOTO FILM CO., LTD. (JA) 1976-01-20 US disclosed
US-3931248-A Reactive high polymer compound FUJI PHOTO FILM CO., LTD. (JA) 1976-01-06 US disclosed