SCHEMBL3142647

SCHEMBL3142647

CCN1C(C)=C(C(C)=O)C(c2ccccc2[N+](=O)[O-])C(C(C)=O)=C1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
MAPT P10636 4/20 0.52
ALDH1A1 P00352 4/20 0.50
KMT2A Q03164 4/20 0.50
CACNA1C Q13936 4/20 0.50
LMNA P02545 3/20 0.50
CACNA1F O60840 3/20 0.50
CACNA1D Q01668 3/20 0.50
CACNA1S Q13698 3/20 0.50
ABCC4 O15439 2/20 0.50
ABCB11 O95342 2/20 0.50
CYP1A2 P05177 2/20 0.50
ADORA3 P0DMS8 2/20 0.50
ADORA2A P29274 2/20 0.50
ADORA1 P30542 2/20 0.50
OPRM1 P35372 2/20 0.50
SCN1A P35498 2/20 0.50
HTR2B P41595 2/20 0.50
KCNH2 Q12809 2/20 0.50
SCN5A Q14524 2/20 0.50

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
SCHEMBL12994290 0.86 LMNA (0.66) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL28770058 0.80 ALDH1A1 (0.48) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL2815053 0.78 MAPT (0.54) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL202183 0.78 CACNA1C (0.73) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL29358809 0.78 CACNA1C (0.73) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL4880010 0.78 CACNA1C (0.46) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL3749490 0.77 ALDH1A1 (0.54) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL7169187 0.77 KDM4E (0.50) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL11689003 0.77 CACNA1D (0.48) KDM4EMAPTALDH1A1KMT2ACACNA1C
SCHEMBL7879407 0.77 CUL4A (0.54) KDM4EMAPTALDH1A1KMT2ACACNA1C

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-7641821-B2 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION (JP) 2010-01-05 US claimed
US-20040178522-A1 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION 2004-09-16 US claimed
EP-1441243-A1 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION (JP) 2004-07-28 EP claimed
US-7641821-B2 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION (JP) 2010-01-05 US disclosed
US-20040178522-A1 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION 2004-09-16 US disclosed
EP-1441243-A1 Process of manufacturing optical waveguide and connection structure of optical devices NITTO DENKO CORPORATION (JP) 2004-07-28 EP disclosed