SCHEMBL5511070

SCHEMBL5511070

O=C1C2C3C=CC(C3)C2C(=O)N1c1c(Cl)cccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
USP2 O75604 1/20 0.50
TSHR P16473 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ESR2 Q92731 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL14494360 0.86 KDM4E (0.41) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1
SCHEMBL5515014 0.81 MEN1 (0.61) TSHRSMN1; SMN2ALDH1A1CA1CA2
SCHEMBL5524440 0.79 TSHR (0.58) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1
SCHEMBL3189623 0.77 CA1 (0.60) KDM4EUSP2TSHRALDH1A1CA1
SCHEMBL5513651 0.77 KDM4E (0.50) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1
SCHEMBL3189633 0.77 CA1 (0.60) KDM4EUSP2TSHRALDH1A1CA1
SCHEMBL4592297 0.77 CA1 (0.60) KDM4EUSP2TSHRALDH1A1CA1
SCHEMBL4020740 0.75 TSHR (0.66) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1
SCHEMBL5922866 0.74 TSHR (0.56) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1
SCHEMBL5922867 0.74 TSHR (0.56) KDM4EUSP2TSHRSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-20060189771-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-08-24 US disclosed
US-20060041092-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-02-23 US disclosed