SCHEMBL7602893

SCHEMBL7602893

C=Cc1ccccc1C(=O)Nc1ccccc1S(=O)(=O)c1ccccc1NC(=O)c1ccccc1C=C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
KMT2A Q03164 2/20 0.42
TP53 P04637 2/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 2/20 0.40
CA12 O43570 1/20 0.40
BCAT2 O15382 1/20 0.40
PABPC1 P11940 1/20 0.39
EIF4H Q15056 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL6551863 0.89 CA1 (0.55) KMT2ANPC1CA1CA2CA9
SCHEMBL7598919 0.77 PRMT1 (0.56) KMT2ALMNAALDH1A1HPGDCA1
SCHEMBL7598925 0.77 CA1 (0.51) L3MBTL1KMT2ATP53NPC1ALDH1A1
SCHEMBL7599801 0.76 CA1 (0.43) KMT2ALMNAALDH1A1HPGDCA1
SCHEMBL7601089 0.76 TDP1 (0.51) L3MBTL1KMT2ALMNAALDH1A1CA1
SCHEMBL4301345 0.75 MAOA (0.56) L3MBTL1KMT2AGAAALDH1A1CYP1A2
SCHEMBL2255814 0.74 ALDH1A1 (0.59) KMT2ATP53LMNAHTTNPC1
SCHEMBL28592452 0.73 ALDH1A1 (0.64) KMT2ANPC1GAAALDH1A1CYP1A2
SCHEMBL7598984 0.73 MAPT (0.51) KMT2ALMNAHTTGAAALDH1A1
SCHEMBL7598988 0.73 MEN1 (0.46) KMT2ALMNANPC1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0913713-B1 Crosslinkable compound and an optical material employing it MENICON CO LTD (JP) 2002-12-18 EP disclosed
US-6015874-A CURING AGENT FOR HYDROPHILIC, TRANSPARENT, DURABLE POLYMERIC CONTACT OR INTRAOCULAR LENSES WHICH ALSO ABSORB ULTRA VIOLET RADIATION AND ARE OXYGEN PERMEABLE MENICON CO., LTD. (JP) 2000-01-18 US disclosed
EP-0913713-A2 Crosslinkable compound and an optical material employing it Menicon Co., Ltd. (JP) 1999-05-06 EP disclosed