SCHEMBL8517854

SCHEMBL8517854

C=CCN1C(=O)[CH]CC1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
CYP3A4 P08684 1/20 0.38
ALDH1A1 P00352 4/20 0.38
CASP3 P42574 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 2/20 0.34
RECQL P46063 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP19A1 P11511 1/20 0.33
CNR1 P21554 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL88581 0.70 CASP3 (0.48) POLBCYP3A4ALDH1A1CASP3L3MBTL1
SCHEMBL16116448 0.70
SCHEMBL288566 0.70 CYP3A4 (0.46) POLBCYP3A4ALDH1A1CASP3CYP1A2
SCHEMBL8903951 0.70 CYP3A4 (0.46) POLBCYP3A4ALDH1A1CASP3CYP1A2
SCHEMBL474426 0.67 CYP3A4 (0.42) POLBCYP3A4ALDH1A1CASP3CYP1A2
SCHEMBL723082 0.67 POLB (0.43) POLBCYP3A4ALDH1A1CASP3CYP1A2
SCHEMBL20204870 0.67 POLB (0.37) POLBCYP3A4ALDH1A1CASP3CYP1A2
SCHEMBL16197017 0.67 NR1I2 (0.31)
SCHEMBL7038598 0.66 CASP3 (0.54) POLBCYP3A4ALDH1A1CASP3L3MBTL1
SCHEMBL4553513 0.65 CYP3A4 (0.41) POLBCYP3A4ALDH1A1CASP3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661310-B1 Cyclo-olefincopolymers and process for their preparation TICONA GMBH (DE) 1999-07-21 EP disclosed
EP-0661308-B1 Cyclo-olefin copolymers and process for their preparation TICONA GMBH (DE) 1999-06-02 EP disclosed
US-5756623-A MOLDING MATERIALS FOR COMPRESSION MOLDING HOECHST AG (DE) 1998-05-26 US disclosed
EP-0661310-A2 Cyclo-olefincopolymers and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed
EP-0661308-A2 Cyclo-olefin copolymers and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed