SCHEMBL7597973

SCHEMBL7597973

C=C(C)C(=O)Nc1cccc(S(=O)(=O)c2cccc(NC(=O)C(=C)C)c2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.64
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 2/20 0.60
USP2 O75604 1/20 0.55
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 3/20 0.51
MAPK1 P28482 1/20 0.51
CA1 P00915 7/20 0.46
CA2 P00918 7/20 0.46
CA12 O43570 5/20 0.46
CA9 Q16790 5/20 0.46
RXFP1 Q9HBX9 1/20 0.45
PKM P14618 1/20 0.45
POLB P06746 2/20 0.44
GPR35 Q9HC97 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RECQL P46063 1/20 0.43

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
SCHEMBL1811660 0.89 TDP1 (0.62) TDP1SMN1; SMN2LMNAUSP2GAA
SCHEMBL396033 0.88 CA1 (0.61) TDP1MAPTCA1CA2CA12
SCHEMBL7601156 0.87 TDP1 (0.54) TDP1SMN1; SMN2LMNAUSP2GAA
SCHEMBL393893 0.86 TDP1 (0.59) TDP1SMN1; SMN2LMNAGAAMAPT
SCHEMBL397453 0.85 KMT2A (0.59) TDP1SMN1; SMN2LMNAHTTMAPT
SCHEMBL1098272 0.84 TDP1 (0.79) TDP1RXFP1POLBGPR35KDM4E
SCHEMBL396170 0.84 TDP1 (0.56) TDP1LMNAGAAHPGDMAPT
SCHEMBL27404350 0.84 TDP1 (0.56) TDP1SMN1; SMN2LMNAUSP2GAA
SCHEMBL11842413 0.84 TDP1 (0.56) TDP1SMN1; SMN2LMNAMAPTMAPK1
SCHEMBL20469325 0.83 SMN1; SMN2 (0.64) SMN1; SMN2LMNAUSP2GAAHPGD

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