SCHEMBL4898507

SCHEMBL4898507

CO[Si](Cn1ccnc1)(OC)OC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.45
CYP11B1 P15538 7/20 0.42
CYP11B2 P19099 6/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP19A1 P11511 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
QPCT Q16769 1/20 0.38
CYP4Z1 Q86W10 1/20 0.38
QPCTL Q9NXS2 1/20 0.38

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
SCHEMBL12802207 0.79 TBXAS1 (0.52) TBXAS1ALDH1A1MEN1KMT2AATM
SCHEMBL2384572 0.79 TBXAS1 (0.44) TBXAS1CYP11B1CYP11B2ALDH1A1CYP19A1
SCHEMBL406663 0.76 TBXAS1 (0.59) TBXAS1ALDH1A1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL27901082 0.75 TBXAS1 (0.57) TBXAS1ALDH1A1MEN1KMT2AATM
SCHEMBL10389710 0.75 TBXAS1 (0.50) TBXAS1CYP11B1CYP11B2ALDH1A1CYP19A1
SCHEMBL21141580 0.74 TBXAS1 (0.55) TBXAS1MEN1KMT2AATMKDM4E
SCHEMBL425674 0.73
SCHEMBL29129773 0.72 TBXAS1 (0.42) TBXAS1CYP11B1CYP11B2ALDH1A1CYP19A1
SCHEMBL27892531 0.72
Methoxymethane SCHEMBL28410718 0.71 ALDH1A1 (0.47) TBXAS1CYP11B1CYP11B2ALDH1A1CYP19A1

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
JP-5039295-A None JP disclosed
US-20080274305-A1 Liquid Crystal Sealant and Liquid Crystal Display Cell Utilizing the Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-11-06 US disclosed
EP-1780587-A1 LIQUID CRYSTAL SEALANT AND LIQUID CRYSTAL DISPLAY CELL UTILIZING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2007-05-02 EP disclosed
US-6445567-B1 Cap member for electrical double layer capacitor container HONDA GIKEN KOGYO KABUSHIKI KAISHA (JP) 2002-09-03 US disclosed
US-20020105776-A1 CAP MEMBER FOR ELECTRICAL DOUBLE LAYER CAPACITOR CONTAINER HONDA GIKEN KOGYO KABUSHIKI KAISHA 2002-08-08 US disclosed
JP-H0539295-A SURFACE-TREATING AGENT FOR METAL NIKKO KYODO CO LTD 1993-02-19 JP disclosed