SCHEMBL13668363

SCHEMBL13668363

CC(C)=Cc1ccc(N=[N+]=[N-])cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.44
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ PTGS2 P35354 3/20 0.39
▸ RAD51 Q06609 1/20 0.36
▸ CYP51A1 Q16850 4/20 0.35
▸ NOX1 Q9Y5S8 1/20 0.35
▸ SCN1A P35498 1/20 0.35
▸ SCN2A Q99250 1/20 0.35
▸ SCN3A Q9NY46 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ PSMB8 P28062 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
SCHEMBL21670328 0.83 ESR1 (0.53) TP53CA1CA2CA9CA5A
SCHEMBL21670327 0.83 ESR1 (0.53) TP53CA1CA2CA9CA5A
SCHEMBL28426802 0.80 AKR1C3 (0.55) TP53CA1CA2CA9CA5A
SCHEMBL23854165 0.76 CA1 (0.47) TP53CA1CA2CA9CA5A
SCHEMBL13882617 0.76 CA1 (0.47) TP53CA1CA2CA9CA5A
SCHEMBL2464948 0.75 ESR1 (0.46) PTGS2ALDH1A1KDM4ECYP2C19GLA
SCHEMBL16748959 0.75 CA1 (0.58) TP53CA1CA2CA9CA5A
SCHEMBL14780999 0.74 GLA (0.52) TP53CA1CA2CA9CA5A
SCHEMBL15457782 0.74 GLA (0.52) TP53CA1CA2CA9CA5A
SCHEMBL13668357 0.73 TP53 (0.42) TP53CA1CA2CA9CA5A

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
US-7605191-B2 polyoxyethylene glycol having end group of acrylamide derivatives, can be curing to provide medical device a surface coating which has hydrophilicity and high bioadaptability TOYO GOSEI CO., LTD. (JP) 2009-10-20 — — US disclosed
US-7605191-B2 polyoxyethylene glycol having end group of acrylamide derivatives, can be curing to provide medical device a surface coating which has hydrophilicity and high bioadaptability TOYO GOSEI CO., LTD. (JP) 2009-10-20 — — US disclosed
US-20090181158-A1 Method of Producing Cell Culture Container TOYO GOSEI CO., LTD. (JP) 2009-07-16 — — US disclosed
US-20090181158-A1 Method of Producing Cell Culture Container TOYO GOSEI CO., LTD. (JP) 2009-07-16 — — US disclosed
EP-2011857-A1 METHOD OF PRODUCING CELL CULTURE CONTAINER Toyo Gosei Co., Ltd. (JP) 2009-01-07 — — EP disclosed
EP-1865012-A1 PHOTOSENSITIVE RESIN, PHOTOSENSITIVE COMPOSITION AND PHOTOCROSSLINKED ITEM Toyo Gosei Kogyo Co., Ltd. (JP) 2007-12-12 — — EP disclosed
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